[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl] 2-[2-(4-chloroanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(4-chloroanilino)-2-oxoethyl]thio]acetic acid [(2R)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl] 2-[2-(4-chloroanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(4-chloroanilino)-2-keto-ethyl]thio]acetic acid [(1R)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C13H15ClN2O4S MolecularWeight: 330.7872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)CSCC(=O)NC1=CC=C(C=C1)Cl

Isomeric SMILES

C[C@H](C(=O)N)OC(=O)CSCC(=O)NC1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H15ClN2O4S/c1-8(13(15)19)20-12(18)7-21-6-11(17)16-10-4-2-9(14)3-5-10/h2-5,8H,6-7H2,1H3,(H2,15,19)(H,16,17)/t8-/m1/s1