(E)-2-cyano-N-(4-methylphenyl)-3-phenacylsulfanyl-3-sulfanyl-prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(4-methylphenyl)-3-phenacylsulfanyl-3-sulfanyl-prop-2-enamide Openeye Name: (E)-2-cyano-3-phenacylsulfanyl-N-(p-tolyl)-3-sulfanyl-prop-2-enamide CAS Name: (E)-2-cyano-3-mercapto-N-(4-methylphenyl)-3-(phenacylthio)-2-propenamide IUPAC Name: (E)-2-cyano-N-(4-methylphenyl)-3-phenacylsulfanyl-3-sulfanylprop-2-enamide Traditional Name: (E)-2-cyano-3-mercapto-3-(phenacylthio)-N-(p-tolyl)acrylamide Formula: C19H16N2O2S2 MolecularWeight: 368.47254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(=C(S)SCC(=O)C2=CC=CC=C2)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)/C(=C(\S)/SCC(=O)C2=CC=CC=C2)/C#N

InChI

InChI=1S/C19H16N2O2S2/c1-13-7-9-15(10-8-13)21-18(23)16(11-20)19(24)25-12-17(22)14-5-3-2-4-6-14/h2-10,24H,12H2,1H3,(H,21,23)/b19-16+