[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] (E)-3-phenylprop-2-enoate

Systemtic Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] (E)-3-phenylprop-2-enoate Openeye Name: [2-oxo-2-[2-(p-tolylsulfanyl)ethylamino]ethyl] (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [2-[2-[(4-methylphenyl)thio]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxoethyl] (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [2-keto-2-[2-(p-tolylthio)ethylamino]ethyl] ester Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)COC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)COC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C20H21NO3S/c1-16-7-10-18(11-8-16)25-14-13-21-19(22)15-24-20(23)12-9-17-5-3-2-4-6-17/h2-12H,13-15H2,1H3,(H,21,22)/b12-9+