[2-[(4-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 2-(2-methylphenyl)ethanoate

Systemtic Name: [2-[(4-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 2-(2-methylphenyl)ethanoate Openeye Name: [2-(4-methylsulfanylanilino)-2-oxo-ethyl] 2-(o-tolyl)acetate CAS Name: 2-(2-methylphenyl)acetic acid [2-[4-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylanilino)-2-oxoethyl] 2-(2-methylphenyl)acetate Traditional Name: 2-(o-tolyl)acetic acid [2-keto-2-[4-(methylthio)anilino]ethyl] ester Formula: C18H19NO3S MolecularWeight: 329.41336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)OCC(=O)NC2=CC=C(C=C2)SC

Isomeric SMILES

CC1=CC=CC=C1CC(=O)OCC(=O)NC2=CC=C(C=C2)SC

InChI

InChI=1S/C18H19NO3S/c1-13-5-3-4-6-14(13)11-18(21)22-12-17(20)19-15-7-9-16(23-2)10-8-15/h3-10H,11-12H2,1-2H3,(H,19,20)