[2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [2-keto-2-[(4-sulfamoylbenzyl)amino]ethyl] ester Formula: C16H17N3O5S2 MolecularWeight: 395.45328

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)OCC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)OCC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C16H17N3O5S2/c1-25-15-13(3-2-8-18-15)16(21)24-10-14(20)19-9-11-4-6-12(7-5-11)26(17,22)23/h2-8H,9-10H2,1H3,(H,19,20)(H2,17,22,23)