4-[[3-[(Z)-2-(4-aminophenyl)sulfanyl-2-azanyl-1-cyano-ethenyl]phenyl]-oxidanyl-methyl]benzenecarbonitrile

Systemtic Name: 4-[[3-[(Z)-2-(4-aminophenyl)sulfanyl-2-azanyl-1-cyano-ethenyl]phenyl]-oxidanyl-methyl]benzenecarbonitrile Openeye Name: 4-[[3-[(Z)-2-amino-2-(4-aminophenyl)sulfanyl-1-cyano-vinyl]phenyl]-hydroxy-methyl]benzonitrile CAS Name: 4-[[3-[(Z)-2-amino-2-[(4-aminophenyl)thio]-1-cyanoethenyl]phenyl]-hydroxymethyl]benzonitrile IUPAC Name: 4-[[3-[(Z)-2-amino-2-(4-aminophenyl)sulfanyl-1-cyanoethenyl]phenyl]-hydroxymethyl]benzonitrile Traditional Name: 4-[[3-[(Z)-2-amino-2-[(4-aminophenyl)thio]-1-cyano-vinyl]phenyl]-hydroxy-methyl]benzonitrile Formula: C23H18N4OS MolecularWeight: 398.48022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(C2=CC=C(C=C2)C#N)O)C(=C(N)SC3=CC=C(C=C3)N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(C2=CC=C(C=C2)C#N)O)/C(=C(\N)/SC3=CC=C(C=C3)N)/C#N

InChI

InChI=1S/C23H18N4OS/c24-13-15-4-6-16(7-5-15)22(28)18-3-1-2-17(12-18)21(14-25)23(27)29-20-10-8-19(26)9-11-20/h1-12,22,28H,26-27H2/b23-21+