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

Systemtic Name: 4-[[3-[(Z)-2-azanyl-1-cyano-2-(2-hydroxyphenyl)sulfanyl-ethenyl]phenyl]-oxidanyl-methyl]benzenecarbonitrile Openeye Name: 4-[[3-[(Z)-2-amino-1-cyano-2-(2-hydroxyphenyl)sulfanyl-vinyl]phenyl]-hydroxy-methyl]benzonitrile CAS Name: 4-[[3-[(Z)-2-amino-1-cyano-2-[(2-hydroxyphenyl)thio]ethenyl]phenyl]-hydroxymethyl]benzonitrile IUPAC Name: 4-[[3-[(Z)-2-amino-1-cyano-2-(2-hydroxyphenyl)sulfanylethenyl]phenyl]-hydroxymethyl]benzonitrile Traditional Name: 4-[[3-[(Z)-2-amino-1-cyano-2-[(2-hydroxyphenyl)thio]vinyl]phenyl]-hydroxy-methyl]benzonitrile Formula: C23H17N3O2S MolecularWeight: 399.46498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H17N3O2S/c24-13-15-8-10-16(11-9-15)22(28)18-5-3-4-17(12-18)19(14-25)23(26)29-21-7-2-1-6-20(21)27/h1-12,22,27-28H,26H2/b23-19+