(E)-3-(cyanomethylsulfanyl)-3-phenylazanyl-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: (E)-3-(cyanomethylsulfanyl)-3-phenylazanyl-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: (E)-3-anilino-2-(benzenesulfonyl)-3-(cyanomethylsulfanyl)prop-2-enenitrile CAS Name: (E)-3-anilino-2-(benzenesulfonyl)-3-(cyanomethylthio)-2-propenenitrile IUPAC Name: (E)-3-anilino-2-(benzenesulfonyl)-3-(cyanomethylsulfanyl)prop-2-enenitrile Traditional Name: (E)-3-anilino-2-besyl-3-(cyanomethylthio)acrylonitrile Formula: C17H13N3O2S2 MolecularWeight: 355.43402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=C(C#N)S(=O)(=O)C2=CC=CC=C2)SCC#N

Isomeric SMILES

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

InChI

InChI=1S/C17H13N3O2S2/c18-11-12-23-17(20-14-7-3-1-4-8-14)16(13-19)24(21,22)15-9-5-2-6-10-15/h1-10,20H,12H2/b17-16+