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

Systemtic Name: (E)-2-cyano-N-(4-methoxyphenyl)-3-phenacylsulfanyl-3-sulfanyl-prop-2-enamide Openeye Name: (E)-2-cyano-N-(4-methoxyphenyl)-3-phenacylsulfanyl-3-sulfanyl-prop-2-enamide CAS Name: (E)-2-cyano-3-mercapto-N-(4-methoxyphenyl)-3-(phenacylthio)-2-propenamide IUPAC Name: (E)-2-cyano-N-(4-methoxyphenyl)-3-phenacylsulfanyl-3-sulfanylprop-2-enamide Traditional Name: (E)-2-cyano-3-mercapto-N-(4-methoxyphenyl)-3-(phenacylthio)acrylamide Formula: C19H16N2O3S2 MolecularWeight: 384.47194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C(=C(S)SCC(=O)C2=CC=CC=C2)C#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)/C(=C(\S)/SCC(=O)C2=CC=CC=C2)/C#N

InChI

InChI=1S/C19H16N2O3S2/c1-24-15-9-7-14(8-10-15)21-18(23)16(11-20)19(25)26-12-17(22)13-5-3-2-4-6-13/h2-10,25H,12H2,1H3,(H,21,23)/b19-16+