1-[[3-cyano-2-(phenylmethylsulfanyl)indolizin-1-yl]disulfanyl]-2-(phenylmethylsulfanyl)indolizine-3-carbonitrile

Systemtic Name: 1-[[3-cyano-2-(phenylmethylsulfanyl)indolizin-1-yl]disulfanyl]-2-(phenylmethylsulfanyl)indolizine-3-carbonitrile Openeye Name: 2-benzylsulfanyl-1-[(2-benzylsulfanyl-3-cyano-indolizin-1-yl)disulfanyl]indolizine-3-carbonitrile CAS Name: 1-[[3-cyano-2-(phenylmethylthio)-1-indolizinyl]disulfanyl]-2-(phenylmethylthio)-3-indolizinecarbonitrile IUPAC Name: 2-benzylsulfanyl-1-[(2-benzylsulfanyl-3-cyanoindolizin-1-yl)disulfanyl]indolizine-3-carbonitrile Traditional Name: 2-(benzylthio)-1-[[2-(benzylthio)-3-cyano-indolizin-1-yl]disulfanyl]indolizine-3-carbonitrile Formula: C32H22N4S4 MolecularWeight: 590.80388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(N3C=CC=CC3=C2SSC4=C5C=CC=CN5C(=C4SCC6=CC=CC=C6)C#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(N3C=CC=CC3=C2SSC4=C5C=CC=CN5C(=C4SCC6=CC=CC=C6)C#N)C#N

InChI

InChI=1S/C32H22N4S4/c33-19-27-29(37-21-23-11-3-1-4-12-23)31(25-15-7-9-17-35(25)27)39-40-32-26-16-8-10-18-36(26)28(20-34)30(32)38-22-24-13-5-2-6-14-24/h1-18H,21-22H2