[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] (2S)-2-[(3-chlorophenyl)sulfonylamino]propanoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] (2S)-2-[(3-chlorophenyl)sulfonylamino]propanoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] (2S)-2-[(3-chlorophenyl)sulfonylamino]propanoate CAS Name: (2S)-2-[(3-chlorophenyl)sulfonylamino]propanoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] (2S)-2-[(3-chlorophenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-[(3-chlorophenyl)sulfonylamino]propionic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C14H16ClN3O5S MolecularWeight: 373.81194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16ClN3O5S/c1-10(14(20)23-9-13(19)17-7-3-6-16)18-24(21,22)12-5-2-4-11(15)8-12/h2,4-5,8,10,18H,3,7,9H2,1H3,(H,17,19)/t10-/m0/s1