[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: [(1R)-2-anilino-1-methyl-2-oxo-ethyl] 2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(3-methylanilino)-2-oxoethyl]thio]acetic acid [(2R)-1-anilino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-anilino-1-oxopropan-2-yl] 2-[2-(3-methylanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(m-toluidino)ethyl]thio]acetic acid [(1R)-2-anilino-2-keto-1-methyl-ethyl] ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)OC(C)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)O[C@H](C)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C20H22N2O4S/c1-14-7-6-10-17(11-14)21-18(23)12-27-13-19(24)26-15(2)20(25)22-16-8-4-3-5-9-16/h3-11,15H,12-13H2,1-2H3,(H,21,23)(H,22,25)/t15-/m1/s1