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

Systemtic Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] (E)-3-(4-cyanophenyl)prop-2-enoate Openeye Name: [2-oxo-2-[2-(p-tolylsulfanyl)ethylamino]ethyl] (E)-3-(4-cyanophenyl)prop-2-enoate CAS Name: (E)-3-(4-cyanophenyl)-2-propenoic acid [2-[2-[(4-methylphenyl)thio]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxoethyl] (E)-3-(4-cyanophenyl)prop-2-enoate Traditional Name: (E)-3-(4-cyanophenyl)acrylic acid [2-keto-2-[2-(p-tolylthio)ethylamino]ethyl] ester Formula: C21H20N2O3S MolecularWeight: 380.4601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O3S/c1-16-2-9-19(10-3-16)27-13-12-23-20(24)15-26-21(25)11-8-17-4-6-18(14-22)7-5-17/h2-11H,12-13,15H2,1H3,(H,23,24)/b11-8+