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

Systemtic Name: 4-[[3-[(Z)-2-azanyl-1-cyano-2-(2-methoxyphenyl)sulfanyl-ethenyl]phenyl]-oxidanyl-methyl]benzenecarbonitrile Openeye Name: 4-[[3-[(Z)-2-amino-1-cyano-2-(2-methoxyphenyl)sulfanyl-vinyl]phenyl]-hydroxy-methyl]benzonitrile CAS Name: 4-[[3-[(Z)-2-amino-1-cyano-2-[(2-methoxyphenyl)thio]ethenyl]phenyl]-hydroxymethyl]benzonitrile IUPAC Name: 4-[[3-[(Z)-2-amino-1-cyano-2-(2-methoxyphenyl)sulfanylethenyl]phenyl]-hydroxymethyl]benzonitrile Traditional Name: 4-[[3-[(Z)-2-amino-1-cyano-2-[(2-methoxyphenyl)thio]vinyl]phenyl]-hydroxy-methyl]benzonitrile Formula: C24H19N3O2S MolecularWeight: 413.49156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1SC(=C(C#N)C2=CC(=CC=C2)C(C3=CC=C(C=C3)C#N)O)N

Isomeric SMILES

COC1=CC=CC=C1S/C(=C(\C#N)/C2=CC(=CC=C2)C(C3=CC=C(C=C3)C#N)O)/N

InChI

InChI=1S/C24H19N3O2S/c1-29-21-7-2-3-8-22(21)30-24(27)20(15-26)18-5-4-6-19(13-18)23(28)17-11-9-16(14-25)10-12-17/h2-13,23,28H,27H2,1H3/b24-20+