Standard Article

Analytical Aspects of Aromatic Amines

Anilines (2007)

  1. Jacob Zabicky

Published Online: 15 DEC 2009

DOI: 10.1002/9780470682531.pat0394

Patai's Chemistry of Functional Groups

Patai's Chemistry of Functional Groups

How to Cite

Zabicky, J. 2009. Analytical Aspects of Aromatic Amines. Patai's Chemistry of Functional Groups. .

Author Information

  1. Ben-Gurion University of the Negev, Department of Chemical Engineering, Beer-Sheva, Israel

Publication History

  1. Published Online: 15 DEC 2009

Chemistry Terms

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Abstract

  • 1
    Introduction
  • 2
    Sample Preparation
  • 3
    End Analysis
  • 4
    Structural Characterization

Keywords:

  • aromatic amines in nature and technology;
  • aniline rearrangement;
  • phenylhydrazine rearrangement and ortho- and para-phenylenediamines;
  • hydrazo rearrangement in Fischer's indole synthesis;
  • N-hydroxyaniline acid-catalyzed conversion;
  • arenesulfenanilide rearrangement;
  • amino sulfoxide synthesis;
  • Dimroth rearrangement (amidine rearrangement)

Featured Compounds

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  1. 1 - 250
Compound 1a
Molecular Weight:93.1265
Molecular Formula:C6H7N
InChIKey:PAYRUJLWNCNPSJ-UHFFFAOYSA-N
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Compound 1b
Molecular Weight:107.1531
Molecular Formula:C7H9N
InChIKey:RNVCVTLRINQCPJ-UHFFFAOYSA-N
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Compound 1c
Molecular Weight:107.1531
Molecular Formula:C7H9N
InChIKey:JJYPMNFTHPTTDI-UHFFFAOYSA-N
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Compound 1d
Molecular Weight:107.1531
Molecular Formula:C7H9N
InChIKey:RZXMPPFPUUCRFN-UHFFFAOYSA-N
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Compound 1e
Molecular Weight:121.1796
Molecular Formula:C8H11N
InChIKey:MLPVBIWIRCKMJV-UHFFFAOYSA-N
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Compound 1f
Molecular Weight:121.1796
Molecular Formula:C8H11N
InChIKey:AMKPQMFZCBTTAT-UHFFFAOYSA-N
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Compound 1g
Molecular Weight:121.1796
Molecular Formula:C8H11N
InChIKey:HRXZRAXKKNUKRF-UHFFFAOYSA-N
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Compound 1h
Molecular Weight:127.572
Molecular Formula:C6H6ClN
InChIKey:QSNSCYSYFYORTR-UHFFFAOYSA-N
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Compound 1i
Molecular Weight:123.1525
Molecular Formula:C7H9NO
InChIKey:BHAAPTBBJKJZER-UHFFFAOYSA-N
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Compound 1j
Molecular Weight:108.1411
Molecular Formula:C6H8N2
InChIKey:GEYOCULIXLDCMW-UHFFFAOYSA-N
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Compound 1k
Molecular Weight:108.1411
Molecular Formula:C6H8N2
InChIKey:WZCQRUWWHSTZEM-UHFFFAOYSA-N
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Compound 1l
Molecular Weight:108.1411
Molecular Formula:C6H8N2
InChIKey:CBCKQZAAMUWICA-UHFFFAOYSA-N
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Compound 1m
Molecular Weight:109.1259
Molecular Formula:C6H7NO
InChIKey:PLIKAWJENQZMHA-UHFFFAOYSA-N
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Compound 1n
Molecular Weight:169.2224
Molecular Formula:C12H11N
InChIKey:TWBPWBPGNQWFSJ-UHFFFAOYSA-N
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Compound 2a
Molecular Weight:121.1796
Molecular Formula:C8H11N
InChIKey:VVAKEQGKZNKUSU-UHFFFAOYSA-N
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Compound 2b
Molecular Weight:121.1796
Molecular Formula:C8H11N
InChIKey:CZZZABOKJQXEBO-UHFFFAOYSA-N
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Compound 2c
Molecular Weight:121.1796
Molecular Formula:C8H11N
InChIKey:VOWZNBNDMFLQGM-UHFFFAOYSA-N
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Compound 2d
Molecular Weight:121.1796
Molecular Formula:C8H11N
InChIKey:UFFBMTHBGFGIHF-UHFFFAOYSA-N
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Compound 2e
Molecular Weight:122.1677
Molecular Formula:C7H10N2
InChIKey:VOZKAJLKRJDJLL-UHFFFAOYSA-N
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Compound 2f
Molecular Weight:122.1677
Molecular Formula:C7H10N2
InChIKey:RLYCRLGLCUXUPO-UHFFFAOYSA-N
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Compound 2g
Molecular Weight:141.598
Molecular Formula:C7H8ClN
InChIKey:CXNVOWPRHWWCQR-UHFFFAOYSA-N
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Compound 2h
Molecular Weight:152.1506
Molecular Formula:C7H8N2O2
InChIKey:XTTIQGSLJBWVIV-UHFFFAOYSA-N
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Compound 3
Molecular Weight:135.2062
Molecular Formula:C9H13N
InChIKey:BMIPMKQAAJKBKP-UHFFFAOYSA-N
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Compound 4a
Molecular Weight:123.1525
Molecular Formula:C7H9NO
InChIKey:VMPITZXILSNTON-UHFFFAOYSA-N
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Compound 4b
Molecular Weight:137.179
Molecular Formula:C8H11NO
InChIKey:WXWCDTXEKCVRRO-UHFFFAOYSA-N
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Compound 4c
Molecular Weight:138.1671
Molecular Formula:C7H10N2O
InChIKey:BAHPQISAXRFLCL-UHFFFAOYSA-N
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Compound 5a
Molecular Weight:198.2637
Molecular Formula:C13H14N2
InChIKey:YBRVSVVVWCFQMG-UHFFFAOYSA-N
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Compound 5b
Molecular Weight:226.3168
Molecular Formula:C15H18N2
InChIKey:WECDUOXQLAIPQW-UHFFFAOYSA-N
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Compound 5c
Molecular Weight:267.154
Molecular Formula:C13H12Cl2N2
InChIKey:IBOFVQJTBBUKMU-UHFFFAOYSA-N
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Compound 6a
Molecular Weight:200.2365
Molecular Formula:C12H12N2O
InChIKey:HLBLWEWZXPIGSM-UHFFFAOYSA-N
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Compound 6b
Molecular Weight:216.302
Molecular Formula:C12H12N2S
InChIKey:ICNFHJVPAJKPHW-UHFFFAOYSA-N
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Compound 7a
Molecular Weight:169.2224
Molecular Formula:C12H11N
InChIKey:DMVOXQPQNTYEKQ-UHFFFAOYSA-N
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Compound 7b
Molecular Weight:184.2371
Molecular Formula:C12H12N2
InChIKey:Not Available
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Compound 7c
Molecular Weight:253.127
Molecular Formula:C12H10Cl2N2
InChIKey:HUWXDEQWWKGHRV-UHFFFAOYSA-N
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Compound 7d
Molecular Weight:212.2902
Molecular Formula:C14H16N2
InChIKey:NUIURNJTPRWVAP-UHFFFAOYSA-N
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Compound 7e
Molecular Weight:244.289
Molecular Formula:C14H16N2O2
InChIKey:JRBJSXQPQWSCCF-UHFFFAOYSA-N
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Compound 8a
Molecular Weight:143.1852
Molecular Formula:C10H9N
InChIKey:RUFPHBVGCFYCNW-UHFFFAOYSA-N
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Compound 8b
Molecular Weight:158.1998
Molecular Formula:C10H10N2
InChIKey:NTNWKDHZTDQSST-UHFFFAOYSA-N
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Compound 8c
Molecular Weight:158.1998
Molecular Formula:C10H10N2
InChIKey:OKBVMLGZPNDWJK-UHFFFAOYSA-N
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Compound 8d
Molecular Weight:158.1998
Molecular Formula:C10H10N2
InChIKey:KQSABULTKYLFEV-UHFFFAOYSA-N
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Compound 8e
Molecular Weight:158.1998
Molecular Formula:C10H10N2
InChIKey:YFOOEYJGMMJJLS-UHFFFAOYSA-N
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Compound 9a
Molecular Weight:143.1852
Molecular Formula:C10H9N
InChIKey:JBIJLHTVPXGSAM-UHFFFAOYSA-N
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Compound 9b
Molecular Weight:158.1998
Molecular Formula:C10H10N2
InChIKey:XTBLDMQMUSHDEN-UHFFFAOYSA-N
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Compound 10a
Molecular Weight:181.2331
Molecular Formula:C13H11N
InChIKey:CYSPWCARDHRYJX-UHFFFAOYSA-N
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Compound 10b
Molecular Weight:181.2331
Molecular Formula:C13H11N
InChIKey:CFRFHWQYWJMEJN-UHFFFAOYSA-N
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Compound 10c
Molecular Weight:181.2331
Molecular Formula:C13H11N
InChIKey:OUGMRQJTULXVDC-UHFFFAOYSA-N
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Compound 11a
Molecular Weight:193.2438
Molecular Formula:C14H11N
InChIKey:YUENFNPLGJCNRB-UHFFFAOYSA-N
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Compound 11b
Molecular Weight:193.2438
Molecular Formula:C14H11N
InChIKey:YCSBALJAGZKWFF-UHFFFAOYSA-N
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Compound 11c
Molecular Weight:193.2438
Molecular Formula:C14H11N
InChIKey:LHNICELDCMPPDE-UHFFFAOYSA-N
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Compound 12
Molecular Weight:193.2438
Molecular Formula:C14H11N
InChIKey:KIHQWOBUUIPWAN-UHFFFAOYSA-N
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Compound 13
Molecular Weight:217.2652
Molecular Formula:C16H11N
InChIKey:YZVWKHVRBDQPMQ-UHFFFAOYSA-N
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Compound 14
Molecular Weight:217.2652
Molecular Formula:C16H11N
InChIKey:VHGJAFIHUSTRGB-UHFFFAOYSA-N
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Compound 15
Molecular Weight:243.3025
Molecular Formula:C18H13N
InChIKey:KIVUHCNVDWYUNP-UHFFFAOYSA-N
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Compound 16a
Molecular Weight:197.2358
Molecular Formula:C12H11N3
InChIKey:QPQKUYVSJWQSDY-UHFFFAOYSA-N
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Compound 16b
Molecular Weight:225.289
Molecular Formula:C14H15N3
InChIKey:PFRYFZZSECNQOL-UHFFFAOYSA-N
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Compound 1
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 2
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 4
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 5
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 6
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 7
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 8
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 9
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 10
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 11
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 16
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 17
Molecular Weight:229.2759
Molecular Formula:C17H11N
InChIKey:JEGZRTMZYUDVBF-UHFFFAOYSA-N
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Compound 18
Molecular Weight:229.2759
Molecular Formula:C17H11N
InChIKey:OAPPEBNXKAKQGS-UHFFFAOYSA-N
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Compound 19
Molecular Weight:279.3346
Molecular Formula:C21H13N
InChIKey:GUZBPGZOTDAWBO-UHFFFAOYSA-N
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Compound 20
Molecular Weight:279.3346
Molecular Formula:C21H13N
InChIKey:JNCSIWAONQTVCF-UHFFFAOYSA-N
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Compound 21
Molecular Weight:279.3346
Molecular Formula:C21H13N
InChIKey:BTVBCAKHMZHLFR-UHFFFAOYSA-N
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Compound 22
Molecular Weight:279.3346
Molecular Formula:C21H13N
InChIKey:ANUCHZVCBDOPOX-UHFFFAOYSA-N
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Compound 23a
Molecular Weight:224.2612
Molecular Formula:C13H12N4
InChIKey:UQVKZNNCIHJZLS-UHFFFAOYSA-N
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Compound 23b
Molecular Weight:162.1918
Molecular Formula:C8H10N4
InChIKey:NEOGGGHDLGYATP-UHFFFAOYSA-N
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Compound 23c
Molecular Weight:176.2184
Molecular Formula:C9H12N4
InChIKey:GWMHBZDOVFZVQC-UHFFFAOYSA-N
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Compound 24
Molecular Weight:176.2184
Molecular Formula:C9H12N4
InChIKey:GQGRXBZBPOQBFQ-UHFFFAOYSA-N
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Compound 25a
Molecular Weight:198.2239
Molecular Formula:C11H10N4
InChIKey:ARZWATDYIYAUTA-UHFFFAOYSA-N
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Compound 25b
Molecular Weight:212.2505
Molecular Formula:C12H12N4
InChIKey:GMGWMIJIGUYNAY-UHFFFAOYSA-N
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Compound 26a
Molecular Weight:213.2385
Molecular Formula:C11H11N5
InChIKey:DVCCCQNKIYNAKB-UHFFFAOYSA-N
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Compound 26b
Molecular Weight:227.2651
Molecular Formula:C12H13N5
InChIKey:LAZSIJHHPMHKQI-UHFFFAOYSA-N
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Compound 26c
Molecular Weight:227.2651
Molecular Formula:C12H13N5
InChIKey:JFQHIQJNQCWLNR-UHFFFAOYSA-N
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Compound 26d
Molecular Weight:241.2917
Molecular Formula:C13H15N5
InChIKey:MCFPPHKNJUOYBX-UHFFFAOYSA-N
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Compound 26e
Molecular Weight:199.212
Molecular Formula:C10H9N5
InChIKey:HKZZYGFWIFKKIR-UHFFFAOYSA-N
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Compound 27
Molecular Weight:227.2651
Molecular Formula:C12H13N5
InChIKey:ZSISUTCDDLFJLH-UHFFFAOYSA-N
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Compound 28a
Molecular Weight:197.2358
Molecular Formula:C12H11N3
InChIKey:LKKMLIBUAXYLOY-UHFFFAOYSA-N
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Compound 28b
Molecular Weight:211.2624
Molecular Formula:C13H13N3
InChIKey:LVTKHGUGBGNBPL-UHFFFAOYSA-N
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Compound 29a
Molecular Weight:184.1973
Molecular Formula:C10H8N4
InChIKey:DOBZLFLJSNAJDC-UHFFFAOYSA-O
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Compound 29b
Molecular Weight:198.2239
Molecular Formula:C11H10N4
InChIKey:VLVYDKHUMDCSFR-UHFFFAOYSA-O
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Compound 30a
Molecular Weight:183.2093
Molecular Formula:C11H9N3
InChIKey:FJTNLJLPLJDTRM-UHFFFAOYSA-N
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Compound 30b
Molecular Weight:197.2358
Molecular Formula:C12H11N3
InChIKey:IVLCGFRPPGNALI-UHFFFAOYSA-N
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Compound 31a
Molecular Weight:168.1946
Molecular Formula:C11H8N2
InChIKey:AIFRHYZBTHREPW-UHFFFAOYSA-N
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Compound 31b
Molecular Weight:182.2212
Molecular Formula:C12H10N2
InChIKey:PSFDQSOCUJVVGF-UHFFFAOYSA-N
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Compound 32a
Molecular Weight:541.826
Molecular Formula:C21H26BrClN6O4
InChIKey:SIVDBALHJJBGLN-UHFFFAOYSA-N
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Compound 32b
Molecular Weight:506.783
Molecular Formula:C20H21BrClN7O2
InChIKey:CVBXOARNTJWWLQ-UHFFFAOYSA-N
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Compound 32c
Molecular Weight:469.72
Molecular Formula:C17H18BrClN6O3
InChIKey:FWVHBJPHUBUTLM-UHFFFAOYSA-N
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Compound 32d
Molecular Weight:425.668
Molecular Formula:C15H14BrClN6O2
InChIKey:HLDQJHAXRNEPPO-UHFFFAOYSA-N
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Compound 32e
Molecular Weight:597.846
Molecular Formula:C23H26BrClN6O6
InChIKey:SKGIVWVJEGIZEZ-UHFFFAOYSA-N
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Compound 32f
Molecular Weight:513.773
Molecular Formula:C19H22BrClN6O4
InChIKey:QAKGYVJZOGCDRV-UHFFFAOYSA-N
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Compound 32g
Molecular Weight:481.774
Molecular Formula:C19H22BrClN6O2
InChIKey:RXJPIXOLVXIWMI-UHFFFAOYSA-N
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Compound 32h
Molecular Weight:505.795
Molecular Formula:C21H22BrClN6O2
InChIKey:ZLGPTNBRKWCBIG-UHFFFAOYSA-N
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Compound 23
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 25
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 26
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 28
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 29
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 30
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 31
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 32
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 92a
Molecular Weight:127.572
Molecular Formula:C6H6ClN
InChIKey:PNPCRKVUWYDDST-UHFFFAOYSA-N
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Compound 39
Molecular Weight:162.017
Molecular Formula:C6H5Cl2N
InChIKey:SDYWXFYBZPNOFX-UHFFFAOYSA-N
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Compound 33
Molecular Weight:317.3479
Molecular Formula:C17H15N7
InChIKey:AEPCSIQNPTZFBP-UHFFFAOYSA-N
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Compound 34
Molecular Weight:314.344
Molecular Formula:C18H14N6
InChIKey:MJFUJKNGFWTFNM-UHFFFAOYSA-N
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Compound 35
Molecular Weight:226.272
Molecular Formula:C18H10
InChIKey:YEIHPPOCKIHUQJ-UHFFFAOYSA-N
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Compound 36
Molecular Weight:276.2861
Molecular Formula:C18H12O3
InChIKey:WYKYLTFPDQSTEC-VEZWFGLTSA-N
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Compound 37
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 38
Molecular Weight:218.08
Molecular Formula:C9H9Cl2NO
InChIKey:LFULEKSKNZEWOE-UHFFFAOYSA-N
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Compound 40
Molecular Weight:113.1179
Molecular Formula:C4H7N3O
InChIKey:Not Available
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Compound 41
Molecular Weight:176.2151
Molecular Formula:C10H12N2O
InChIKey:UIKROCXWUNQSPJ-UHFFFAOYSA-N
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Compound 42
Molecular Weight:290.2681
Molecular Formula:C15H14O6
InChIKey:PFTAWBLQPZVEMU-DZGCQCFKSA-N
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Compound 43
Molecular Weight:400.3853
Molecular Formula:C19H20N4O6
InChIKey:SQVPGYDPSLNFET-JSMXJDTGSA-N
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Compound 44
Molecular Weight:416.3847
Molecular Formula:C19H20N4O7
InChIKey:LFTPLKZVZBHHME-JSMXJDTGSA-N
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Compound 45
Molecular Weight:416.3847
Molecular Formula:C19H20N4O7
InChIKey:BCCSGKXMGIATRE-JSMXJDTGSA-N
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Compound 46
Molecular Weight:320.324
Molecular Formula:C13H12N4O4S
InChIKey:SSEWDBILXMYUPG-UHFFFAOYSA-N
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Compound 47a
Molecular Weight:775.1953
Molecular Formula:C54H78O3
InChIKey:VSAWBBYYMBQKIK-UHFFFAOYSA-N
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Compound 48a
Molecular Weight:405.5738
Molecular Formula:C30H31N
InChIKey:UJAWGGOCYUPCPS-UHFFFAOYSA-N
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Compound 49a
Molecular Weight:480.7235
Molecular Formula:C28H52N2O4
InChIKey:XITRBUPOXXBIJN-UHFFFAOYSA-N
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Compound 47b
Molecular Weight:773.1794
Molecular Formula:C54H76O3
InChIKey:PSRYJOAJJKCVNH-UHFFFAOYSA-N
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Compound 47c
Molecular Weight:771.1636
Molecular Formula:C54H74O3
InChIKey:KPFXGIWHLNZREI-UHFFFAOYSA-N
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Compound 47d
Molecular Weight:769.1477
Molecular Formula:C54H72O3
InChIKey:VDDPNGNCUBSZKJ-UHFFFAOYSA-N
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Compound 49b
Molecular Weight:494.7501
Molecular Formula:C29H54N2O4
InChIKey:SFMFUPJQLLKCHO-UHFFFAOYSA-N
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Compound 49c
Molecular Weight:540.7754
Molecular Formula:C30H56N2O6
InChIKey:AOFZLEPZMKINKV-UHFFFAOYSA-N
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Compound 50
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 51
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 52
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 53
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 54
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 47
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 47'
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 47''
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 48
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 48b
Molecular Weight:433.5839
Molecular Formula:C31H31NO
InChIKey:XYZDUMNCICRGSB-UHFFFAOYSA-N
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Compound 49
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 55
Molecular Weight:480.422
Molecular Formula:C18H16N2Na2O7S2
InChIKey:YJVBLROMQZEFPA-UHFFFAOYSA-L
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Compound 56
Molecular Weight:748.738
Molecular Formula:C36H28N6Na2O6S2
InChIKey:ZURSFZUHDIEJAK-UHFFFAOYSA-L
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Compound 57
Molecular Weight:614.61
Molecular Formula:C30H24N8NaO4S
InChIKey:GCVRHDDMZGWMTM-UHFFFAOYSA-M
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Compound 58
Molecular Weight:920.903
Molecular Formula:C40H32N10Na2O8S3
InChIKey:MBGRRPKUKCYNSQ-UHFFFAOYSA-L
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Compound 59
Molecular Weight:572.527
Molecular Formula:C22H16N6O9S2
InChIKey:HKJKONMZMPUGHJ-BZHOXZENSA-N
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Compound 60
Molecular Weight:319.311
Molecular Formula:C10H9NO7S2
InChIKey:APRRQJCCBSJQOQ-UHFFFAOYSA-N
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Compound 61
Molecular Weight:527.53
Molecular Formula:C22H17N5O7S2
InChIKey:WGIIJSJDWAQMMF-JQRDNDPDSA-N
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Compound 62
Molecular Weight:327.335
Molecular Formula:C16H12N2O4S
InChIKey:RDUJRVXKAIVTDH-ISLYRVAYSA-M
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Compound 63
Molecular Weight:173.19
Molecular Formula:C6H7NO3S
InChIKey:HVBSAKJJOYLTQU-UHFFFAOYSA-N
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Compound 64
Molecular Weight:159.1846
Molecular Formula:C10H9NO
InChIKey:FHMMQQXRSYSWCM-UHFFFAOYSA-N
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Compound 65
Molecular Weight:666.614
Molecular Formula:C20H19N3O15S4
InChIKey:XOEMFWGVEBGSBX-GHVJWSGMSA-K
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Compound 66
Molecular Weight:319.3605
Molecular Formula:C18H17N5O
InChIKey:GKAOBOPRVZDJRU-CJLVFECKSA-N
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Compound 67
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 68
Molecular Weight:328.108
Molecular Formula:C12H7Cl2N3O4
InChIKey:CXZWPOHUORSXOH-UHFFFAOYSA-N
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Compound 69
Molecular Weight:Not Available
Molecular Formula:(C2H4O)nC14H22O
InChIKey:JYCQQPHGFMYQCF-UHFFFAOYSA-N
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Compound 70
Molecular Weight:277.19
Molecular Formula:C12H18Cl2N2O
InChIKey:STJMRWALKKWQGH-UHFFFAOYSA-N
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Compound 71
Molecular Weight:319.227
Molecular Formula:C14H20Cl2N2O2
InChIKey:VSGOFXGCBVFZIV-UHFFFAOYSA-N
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Compound 72
Molecular Weight:358.3469
Molecular Formula:C21H14N2O4
InChIKey:XQUPVDVFXZDTLT-UHFFFAOYSA-N
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Compound 73
Molecular Weight:314.407
Molecular Formula:C12H21N2O3PS
InChIKey:Not Available
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Compound 74
Molecular Weight:408.406
Molecular Formula:C16H12N2O7S2
InChIKey:KEYWXKLGZZGHMT-ISLYRVAYSA-N
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Compound 75
Molecular Weight:535.505
Molecular Formula:C20H14N2O10S3
InChIKey:IRPXADUBAQAOKL-QURGRASLSA-K
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Compound 76
Molecular Weight:179.2173
Molecular Formula:C13H9N
InChIKey:Not Available
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Compound 77
Molecular Weight:129.1586
Molecular Formula:C9H7N
InChIKey:SMWDFEZZVXVKRB-UHFFFAOYSA-N
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Compound 78
Molecular Weight:160.56
Molecular Formula:C2H6ClO2PS
InChIKey:XFBJRFNXPUCPKU-UHFFFAOYSA-N
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Compound 79
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 81
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 80
Molecular Weight:119.1622
Molecular Formula:C5H13NO2
InChIKey:ZSXGLVDWWRXATF-UHFFFAOYSA-N
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Compound 82
Molecular Weight:307.03
Molecular Formula:C9H5BrF6
InChIKey:ATLQGZVLWOURFU-UHFFFAOYSA-N
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Compound 83
Molecular Weight:304.296
Molecular Formula:C10H8O7S2
InChIKey:USWINTIHFQKJTR-UHFFFAOYSA-N
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Compound 84
Molecular Weight:283.257
Molecular Formula:C11H9NO6S
InChIKey:AJYAHQXSHSKEQI-UHFFFAOYSA-N
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Compound 85
Molecular Weight:144.1699
Molecular Formula:C10H8O
InChIKey:KJCVRFUGPWSIIH-UHFFFAOYSA-N
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Compound 86
Molecular Weight:172.205
Molecular Formula:C6H8N2O2S
InChIKey:FDDDEECHVMSUSB-UHFFFAOYSA-N
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Compound 86'
Molecular Weight:194.1873
Molecular Formula:C9H10N2O3
InChIKey:HSMNQINEKMPTIC-UHFFFAOYSA-N
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Compound 111d
Molecular Weight:135.1632
Molecular Formula:C8H9NO
InChIKey:GPRYKVSEZCQIHD-UHFFFAOYSA-N
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Compound 87
Molecular Weight:187.2609
Molecular Formula:C12H14N2
InChIKey:NULAJYZBOLVQPQ-UHFFFAOYSA-O
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Compound 88
Molecular Weight:278.33
Molecular Formula:C12H14N4O2S
InChIKey:ASWVTGNCAZCNNR-UHFFFAOYSA-N
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Compound 89
Molecular Weight:299.796
Molecular Formula:C14H22ClN3O2
InChIKey:TTWJBBZEZQICBI-UHFFFAOYSA-N
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Compound 90a
Molecular Weight:494.264
Molecular Formula:C23H12Cl2N4O5
InChIKey:XUKNSVZRTGCRPH-UHFFFAOYSA-M
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Compound 90b
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 91
Molecular Weight:213.661
Molecular Formula:C10H12ClNO2
InChIKey:CWJSHJJYOPWUGX-UHFFFAOYSA-N
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Compound 92b
Molecular Weight:143.571
Molecular Formula:C6H6ClNO
InChIKey:ZYZQSCWSPFLAFM-UHFFFAOYSA-N
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Compound 92c
Molecular Weight:157.598
Molecular Formula:C7H8ClNO
InChIKey:XQVCBOLNTSUFGD-UHFFFAOYSA-N
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Compound 90
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 92
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 93
Molecular Weight:278.2589
Molecular Formula:C17H10O4
InChIKey:Not Available
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Compound 94
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 95a
Molecular Weight:273.714
Molecular Formula:C15H12ClNO2
InChIKey:ZQISHIVJKOSHSB-UHFFFAOYSA-N
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Compound 95b
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 95
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 97
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 96
Molecular Weight:86.0462
Molecular Formula:C3H2O3
InChIKey:KKHUSADXXDNRPW-UHFFFAOYSA-N
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Compound 98a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 98b
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 98
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 99
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 99a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 99b
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 100
Molecular Weight:253.278
Molecular Formula:C10H11N3O3S
InChIKey:JLKIGFTWXXRPMT-UHFFFAOYSA-N
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Compound 139
Molecular Weight:253.278
Molecular Formula:C10H11N3O3S
InChIKey:JLKIGFTWXXRPMT-UHFFFAOYSA-N
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Compound 101
Molecular Weight:255.317
Molecular Formula:C9H9N3O2S2
InChIKey:JNMRHUJNCSQMMB-UHFFFAOYSA-N
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Compound 141
Molecular Weight:255.317
Molecular Formula:C9H9N3O2S2
InChIKey:JNMRHUJNCSQMMB-UHFFFAOYSA-N
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Compound 102
Molecular Weight:280.303
Molecular Formula:C11H12N4O3S
InChIKey:VLYWMPOKSSWJAL-UHFFFAOYSA-N
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Compound 103
Molecular Weight:250.277
Molecular Formula:C10H10N4O2S
InChIKey:SEEPANYCNGTZFQ-UHFFFAOYSA-N
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Compound 104
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 105
Molecular Weight:317.3479
Molecular Formula:C17H15N7
InChIKey:AEPCSIQNPTZFBP-UHFFFAOYSA-N
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Compound 106
Molecular Weight:314.344
Molecular Formula:C18H14N6
InChIKey:MJFUJKNGFWTFNM-UHFFFAOYSA-N
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Compound 107a
Molecular Weight:285.3045
Molecular Formula:C13H15N7O
InChIKey:WRYWVGIIYHVDIP-UHFFFAOYSA-N
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Compound 107b
Molecular Weight:285.3045
Molecular Formula:C13H15N7O
InChIKey:PFUUOMCZUIKJAN-UHFFFAOYSA-N
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Compound 107c
Molecular Weight:271.2779
Molecular Formula:C12H13N7O
InChIKey:CDSMKZWCKLXQGJ-UHFFFAOYSA-N
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Compound 107d
Molecular Weight:271.2779
Molecular Formula:C12H13N7O
InChIKey:HBYZCYIFNPWBMR-UHFFFAOYSA-N
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Compound 107e
Molecular Weight:271.2779
Molecular Formula:C12H13N7O
InChIKey:QNRKVZKPRDXHSB-UHFFFAOYSA-N
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Compound 108a
Molecular Weight:401.4197
Molecular Formula:C18H23N7O4
InChIKey:YQDXXCDOPMPFKC-QJPTWQEYSA-N
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Compound 108b
Molecular Weight:401.4197
Molecular Formula:C18H23N7O4
InChIKey:WYAZKIAFECWTCR-YNEHKIRRSA-N
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Compound 108c
Molecular Weight:401.4197
Molecular Formula:C18H23N7O4
InChIKey:VGQNSVUOGSKBDQ-YNEHKIRRSA-N
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Compound 108d
Molecular Weight:401.4197
Molecular Formula:C18H23N7O4
InChIKey:HRIDSNDETRETTG-YNEHKIRRSA-N
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Compound 108e
Molecular Weight:401.4197
Molecular Formula:C18H23N7O4
InChIKey:MMRPJGPOIGVALV-YNEHKIRRSA-N
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Compound 108f
Molecular Weight:401.4197
Molecular Formula:C18H23N7O4
InChIKey:ZIHCDEAOTKFHBX-YNEHKIRRSA-N
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Compound 108g
Molecular Weight:401.4197
Molecular Formula:C18H23N7O4
InChIKey:OVVIUNVYUJHVJO-YNEHKIRRSA-N
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Compound 108
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 107
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 109
Molecular Weight:110.1106
Molecular Formula:C6H6O2
InChIKey:YCIMNLLNPGFGHC-UHFFFAOYSA-N
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Compound 110
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 111a
Molecular Weight:165.1891
Molecular Formula:C9H11NO2
InChIKey:BLFLLBZGZJTVJG-UHFFFAOYSA-N
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Compound 111b
Molecular Weight:236.3101
Molecular Formula:C13H20N2O2
InChIKey:MFDFERRIHVXMIY-UHFFFAOYSA-N
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Compound 111c
Molecular Weight:235.3253
Molecular Formula:C13H21N3O
InChIKey:REQCZEXYDRLIBE-UHFFFAOYSA-N
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Compound 112a
Molecular Weight:214.245
Molecular Formula:C7H10N4O2S
InChIKey:BRBKOPJOKNSWSG-UHFFFAOYSA-N
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Compound 112b
Molecular Weight:214.242
Molecular Formula:C8H10N2O3S
InChIKey:SKIVFJLNDNKQPD-UHFFFAOYSA-N
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Compound 112c
Molecular Weight:284.358
Molecular Formula:C10H12N4O2S2
InChIKey:SVYBEBLNQGDRHF-UHFFFAOYSA-N
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Compound 113
Molecular Weight:271.316
Molecular Formula:C9H9N3O3S2
InChIKey:ABFBJZCDDNRMGY-UHFFFAOYSA-N
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Compound 114
Molecular Weight:238.2414
Molecular Formula:C14H10N2O2
InChIKey:LRMDXTVKVHKWEK-UHFFFAOYSA-N
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Compound 115
Molecular Weight:208.2585
Molecular Formula:C14H12N2
InChIKey:VPRFQZSTJXHBHL-UHFFFAOYSA-N
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Compound 111
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 112
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 116
Molecular Weight:735.749
Molecular Formula:C34H27N9O7S2
InChIKey:ATFARZXNCCWOKJ-MGDYUOCISA-L
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Compound 117
Molecular Weight:618.571
Molecular Formula:C28H25N6Na2O6S
InChIKey:VHGDEGWDHMWQLR-DUCFOALUSA-L
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Compound 119
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 118
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 120
Molecular Weight:290.3177
Molecular Formula:C14H18N4O3
InChIKey:Not Available
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Compound 140
Molecular Weight:290.3177
Molecular Formula:C14H18N4O3
InChIKey:Not Available
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Compound 121
Molecular Weight:107.11
Molecular Formula:C6H5NO
InChIKey:WELKBINNNXKQQS-UHFFFAOYSA-N
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Compound 122
Molecular Weight:216.2359
Molecular Formula:C12H12N2O2
InChIKey:YSEZYTBJVFVDGY-UHFFFAOYSA-N
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Compound 123
Molecular Weight:323.3459
Molecular Formula:C18H17N3O3
InChIKey:JPTCJLHCFARKOM-UHFFFAOYSA-N
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Compound 124
Molecular Weight:321.33
Molecular Formula:C18H15N3O3
InChIKey:BSLBYBXCGTZDFK-ISPAOBMBSA-N
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Compound 125
Molecular Weight:514.442
Molecular Formula:C20H14N4Na2O6S2
InChIKey:DDIHLFCSEHAOJZ-UHFFFAOYSA-L
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Compound 126
Molecular Weight:1543.326
Molecular Formula:C60H42N12Na6O18S6
InChIKey:GDQYDXKWSAKSIT-UHFFFAOYSA-H
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Compound 127a
Molecular Weight:260.548
Molecular Formula:C6HClN4O6
InChIKey:MPAKVNRHSJKKQU-UHFFFAOYSA-N
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Compound 128a
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 127b
Molecular Weight:244.549
Molecular Formula:C6HClN4O5
InChIKey:QTNZXTGUZLGWBY-UHFFFAOYSA-N
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