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

Systemtic Name: 4-[[3-[(Z)-2-azanyl-1-cyano-2-phenylsulfanyl-ethenyl]phenyl]-oxidanyl-methyl]benzenecarbonitrile Openeye Name: 4-[[3-[(Z)-2-amino-1-cyano-2-phenylsulfanyl-vinyl]phenyl]-hydroxy-methyl]benzonitrile CAS Name: 4-[[3-[(Z)-2-amino-1-cyano-2-(phenylthio)ethenyl]phenyl]-hydroxymethyl]benzonitrile IUPAC Name: 4-[[3-[(Z)-2-amino-1-cyano-2-phenylsulfanylethenyl]phenyl]-hydroxymethyl]benzonitrile Traditional Name: 4-[[3-[(Z)-2-amino-1-cyano-2-(phenylthio)vinyl]phenyl]-hydroxy-methyl]benzonitrile Formula: C23H17N3OS MolecularWeight: 383.46558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C23H17N3OS/c24-14-16-9-11-17(12-10-16)22(27)19-6-4-5-18(13-19)21(15-25)23(26)28-20-7-2-1-3-8-20/h1-13,22,27H,26H2/b23-21+