[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] (2S)-2-(4-methylphenyl)sulfanylpropanoate

Systemtic Name: [2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] (2S)-2-(4-methylphenyl)sulfanylpropanoate Openeye Name: [2-(o-tolylmethylamino)-2-oxo-ethyl] (2S)-2-(p-tolylsulfanyl)propanoate CAS Name: (2S)-2-[(4-methylphenyl)thio]propanoic acid [2-[(2-methylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylphenyl)methylamino]-2-oxoethyl] (2S)-2-(4-methylphenyl)sulfanylpropanoate Traditional Name: (2S)-2-(p-tolylthio)propionic acid [2-keto-2-[(2-methylbenzyl)amino]ethyl] ester Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C)C(=O)OCC(=O)NCC2=CC=CC=C2C

Isomeric SMILES

CC1=CC=C(C=C1)S[C@@H](C)C(=O)OCC(=O)NCC2=CC=CC=C2C

InChI

InChI=1S/C20H23NO3S/c1-14-8-10-18(11-9-14)25-16(3)20(23)24-13-19(22)21-12-17-7-5-4-6-15(17)2/h4-11,16H,12-13H2,1-3H3,(H,21,22)/t16-/m0/s1