1,5-bis(butylamino)-4-butylsulfanyl-8-phenylsulfanyl-anthracene-9,10-dione

Systemtic Name: 1,5-bis(butylamino)-4-butylsulfanyl-8-phenylsulfanyl-anthracene-9,10-dione Openeye Name: 1,5-bis(butylamino)-4-butylsulfanyl-8-phenylsulfanyl-anthracene-9,10-dione CAS Name: 1,5-bis(butylamino)-4-(butylthio)-8-(phenylthio)anthracene-9,10-dione IUPAC Name: 1,5-bis(butylamino)-4-butylsulfanyl-8-phenylsulfanylanthracene-9,10-dione Traditional Name: 1,5-bis(butylamino)-4-(butylthio)-8-(phenylthio)-9,10-anthraquinone Formula: C32H38N2O2S2 MolecularWeight: 546.78632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C2C(=C(C=C1)SCCCC)C(=O)C3=C(C=CC(=C3C2=O)SC4=CC=CC=C4)NCCCC

Isomeric SMILES

CCCCNC1=C2C(=C(C=C1)SCCCC)C(=O)C3=C(C=CC(=C3C2=O)SC4=CC=CC=C4)NCCCC

InChI

InChI=1S/C32H38N2O2S2/c1-4-7-19-33-23-15-17-25(37-21-9-6-3)29-27(23)32(36)30-26(38-22-13-11-10-12-14-22)18-16-24(28(30)31(29)35)34-20-8-5-2/h10-18,33-34H,4-9,19-21H2,1-3H3