[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 5-[2-(methylsulfonylamino)ethyl]thiophene-2-carboxylate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 5-[2-(methylsulfonylamino)ethyl]thiophene-2-carboxylate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxylate CAS Name: 5-[2-(methanesulfonamido)ethyl]-2-thiophenecarboxylic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxylate Traditional Name: 5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxylic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C13H17N3O5S2 MolecularWeight: 359.42118

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCC1=CC=C(S1)C(=O)OCC(=O)NCCC#N

Isomeric SMILES

CS(=O)(=O)NCCC1=CC=C(S1)C(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C13H17N3O5S2/c1-23(19,20)16-8-5-10-3-4-11(22-10)13(18)21-9-12(17)15-7-2-6-14/h3-4,16H,2,5,7-9H2,1H3,(H,15,17)