COMPOUND RECORD : 2-[5,6-diamino-4,7-bis(4-pentylphenoxy)-1,3-benzodithiol-2-ylidene]-4,7-bis(4-pentylphenoxy)-1,3-benzodithiole-5,6-diamine


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Summary

Compound Information

FormulaC58H68N4O4S4
Molecular Weight1013.445
SynonymsNot available

Structure Descriptors

SMILES:CCCCCC1=CC=C(OC2=C3SC(SC3=C(OC3=CC=C(CCCCC)C=C3)C(N)=C2N)=C2SC3=C(S2)C(OC2=CC=C(CCCCC)C=C2)=C(N)C(N)=C3OC2=CC=C(CCCCC)C=C2)C=C1
InChI:1S/C58H68N4O4S4/c1-5-9-13-17-37-21-29-41(30-22-37)63-49-45(59)46(60)50(64-42-31-23-38(24-32-42)18-14-10-6-2)54-53(49)67-57(68-54)58-69-55-51(65-43-33-25-39(26-34-43)19-15-11-7-3)47(61)48(62)52(56(55)70-58)66-44-35-27-40(28-36-44)20-16-12-8-4/h21-36H,5-20,59-62H2,1-4H3
InChIKey:GRIGEVASKISWAK-UHFFFAOYSA-N