[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl] (2R)-2-phenylsulfanylpropanoate

Systemtic Name: [2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl] (2R)-2-phenylsulfanylpropanoate Openeye Name: [2-(3-methylanilino)-2-oxo-ethyl] (2R)-2-phenylsulfanylpropanoate CAS Name: (2R)-2-(phenylthio)propanoic acid [2-(3-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylanilino)-2-oxoethyl] (2R)-2-phenylsulfanylpropanoate Traditional Name: (2R)-2-(phenylthio)propionic acid [2-keto-2-(m-toluidino)ethyl] ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)COC(=O)C(C)SC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)COC(=O)[C@@H](C)SC2=CC=CC=C2

InChI

InChI=1S/C18H19NO3S/c1-13-7-6-8-15(11-13)19-17(20)12-22-18(21)14(2)23-16-9-4-3-5-10-16/h3-11,14H,12H2,1-2H3,(H,19,20)/t14-/m1/s1