[1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-phenylsulfanylpropanoate

Systemtic Name: [1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-phenylsulfanylpropanoate Openeye Name: [1-methyl-2-(3-methylanilino)-2-oxo-ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [1-(3-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-methylanilino)-1-oxopropan-2-yl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [2-keto-1-methyl-2-(m-toluidino)ethyl] ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(C)OC(=O)CCSC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C(C)OC(=O)CCSC2=CC=CC=C2

InChI

InChI=1S/C19H21NO3S/c1-14-7-6-8-16(13-14)20-19(22)15(2)23-18(21)11-12-24-17-9-4-3-5-10-17/h3-10,13,15H,11-12H2,1-2H3,(H,20,22)