[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] (2R)-2-(4-chlorophenyl)sulfanylpropanoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] (2R)-2-(4-chlorophenyl)sulfanylpropanoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] (2R)-2-(4-chlorophenyl)sulfanylpropanoate CAS Name: (2R)-2-[(4-chlorophenyl)thio]propanoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] (2R)-2-(4-chlorophenyl)sulfanylpropanoate Traditional Name: (2R)-2-[(4-chlorophenyl)thio]propionic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C14H15ClN2O3S MolecularWeight: 326.7985

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NCCC#N)SC1=CC=C(C=C1)Cl

Isomeric SMILES

C[C@H](C(=O)OCC(=O)NCCC#N)SC1=CC=C(C=C1)Cl

InChI

InChI=1S/C14H15ClN2O3S/c1-10(21-12-5-3-11(15)4-6-12)14(19)20-9-13(18)17-8-2-7-16/h3-6,10H,2,8-9H2,1H3,(H,17,18)/t10-/m1/s1