[2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl] (E)-3-(4-methylphenyl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl] (E)-3-(4-methylphenyl)prop-2-enoate Openeye Name: [2-(2-allylsulfanylanilino)-2-oxo-ethyl] (E)-3-(p-tolyl)prop-2-enoate CAS Name: (E)-3-(4-methylphenyl)-2-propenoic acid [2-oxo-2-[2-(prop-2-enylthio)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(2-prop-2-enylsulfanylanilino)ethyl] (E)-3-(4-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(p-tolyl)acrylic acid [2-[2-(allylthio)anilino]-2-keto-ethyl] ester Formula: C21H21NO3S MolecularWeight: 367.46134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)OCC(=O)NC2=CC=CC=C2SCC=C

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)OCC(=O)NC2=CC=CC=C2SCC=C

InChI

InChI=1S/C21H21NO3S/c1-3-14-26-19-7-5-4-6-18(19)22-20(23)15-25-21(24)13-12-17-10-8-16(2)9-11-17/h3-13H,1,14-15H2,2H3,(H,22,23)/b13-12+