[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] (E)-3-phenylsulfanylprop-2-enoate

Systemtic Name: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] (E)-3-phenylsulfanylprop-2-enoate Openeye Name: [2-(2-methylanilino)-2-oxo-ethyl] (E)-3-phenylsulfanylprop-2-enoate CAS Name: (E)-3-(phenylthio)-2-propenoic acid [2-(2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylanilino)-2-oxoethyl] (E)-3-phenylsulfanylprop-2-enoate Traditional Name: (E)-3-(phenylthio)acrylic acid [2-keto-2-(o-toluidino)ethyl] ester Formula: C18H17NO3S MolecularWeight: 327.39748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)COC(=O)C=CSC2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC=C1NC(=O)COC(=O)/C=C/SC2=CC=CC=C2

InChI

InChI=1S/C18H17NO3S/c1-14-7-5-6-10-16(14)19-17(20)13-22-18(21)11-12-23-15-8-3-2-4-9-15/h2-12H,13H2,1H3,(H,19,20)/b12-11+