[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl] 2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: [(2S)-1-azanyl-1-oxidanylidene-propan-2-yl] 2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: [(1S)-2-amino-1-methyl-2-oxo-ethyl] 2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(4-methylanilino)-2-oxoethyl]thio]acetic acid [(2S)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-amino-1-oxopropan-2-yl] 2-[2-(4-methylanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(p-toluidino)ethyl]thio]acetic acid [(1S)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(=O)OC(C)C(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O4S/c1-9-3-5-11(6-4-9)16-12(17)7-21-8-13(18)20-10(2)14(15)19/h3-6,10H,7-8H2,1-2H3,(H2,15,19)(H,16,17)/t10-/m0/s1