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

Systemtic Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] (E)-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: [2-oxo-2-[2-(p-tolylsulfanyl)ethylamino]ethyl] (E)-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-methoxyphenyl)-2-propenoic acid [2-[2-[(4-methylphenyl)thio]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxoethyl] (E)-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-methoxyphenyl)acrylic acid [2-keto-2-[2-(p-tolylthio)ethylamino]ethyl] ester Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO4S/c1-16-3-10-19(11-4-16)27-14-13-22-20(23)15-26-21(24)12-7-17-5-8-18(25-2)9-6-17/h3-12H,13-15H2,1-2H3,(H,22,23)/b12-7+