[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] (2S)-2-phenylsulfanylpropanoate

Systemtic Name: [2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] (2S)-2-phenylsulfanylpropanoate Openeye Name: [2-(o-tolylmethylamino)-2-oxo-ethyl] (2S)-2-phenylsulfanylpropanoate CAS Name: (2S)-2-(phenylthio)propanoic acid [2-[(2-methylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylphenyl)methylamino]-2-oxoethyl] (2S)-2-phenylsulfanylpropanoate Traditional Name: (2S)-2-(phenylthio)propionic acid [2-keto-2-[(2-methylbenzyl)amino]ethyl] ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)COC(=O)C(C)SC2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)COC(=O)[C@H](C)SC2=CC=CC=C2

InChI

InChI=1S/C19H21NO3S/c1-14-8-6-7-9-16(14)12-20-18(21)13-23-19(22)15(2)24-17-10-4-3-5-11-17/h3-11,15H,12-13H2,1-2H3,(H,20,21)/t15-/m0/s1