[2-[2-(2-methylphenyl)ethylamino]-2-oxidanylidene-ethyl] (2R)-2-(4-methylphenyl)sulfanylpropanoate

Systemtic Name: [2-[2-(2-methylphenyl)ethylamino]-2-oxidanylidene-ethyl] (2R)-2-(4-methylphenyl)sulfanylpropanoate Openeye Name: [2-[2-(o-tolyl)ethylamino]-2-oxo-ethyl] (2R)-2-(p-tolylsulfanyl)propanoate CAS Name: (2R)-2-[(4-methylphenyl)thio]propanoic acid [2-[2-(2-methylphenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2-methylphenyl)ethylamino]-2-oxoethyl] (2R)-2-(4-methylphenyl)sulfanylpropanoate Traditional Name: (2R)-2-(p-tolylthio)propionic acid [2-keto-2-[2-(o-tolyl)ethylamino]ethyl] ester Formula: C21H25NO3S MolecularWeight: 371.4931

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C)C(=O)OCC(=O)NCCC2=CC=CC=C2C

Isomeric SMILES

CC1=CC=C(C=C1)S[C@H](C)C(=O)OCC(=O)NCCC2=CC=CC=C2C

InChI

InChI=1S/C21H25NO3S/c1-15-8-10-19(11-9-15)26-17(3)21(24)25-14-20(23)22-13-12-18-7-5-4-6-16(18)2/h4-11,17H,12-14H2,1-3H3,(H,22,23)/t17-/m1/s1