1-[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl]-N-(4-sulfamoylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl]-N-(4-sulfamoylphenyl)piperidine-4-carboxamide Openeye Name: 1-[2-(2-cyanoethylamino)-2-oxo-ethyl]-N-(4-sulfamoylphenyl)piperidine-4-carboxamide CAS Name: 1-[2-(2-cyanoethylamino)-2-oxoethyl]-N-(4-sulfamoylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(2-cyanoethylamino)-2-oxoethyl]-N-(4-sulfamoylphenyl)piperidine-4-carboxamide Traditional Name: 1-[2-(2-cyanoethylamino)-2-keto-ethyl]-N-(4-sulfamoylphenyl)isonipecotamide Formula: C17H23N5O4S MolecularWeight: 393.46062

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)CC(=O)NCCC#N

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)CC(=O)NCCC#N

InChI

InChI=1S/C17H23N5O4S/c18-8-1-9-20-16(23)12-22-10-6-13(7-11-22)17(24)21-14-2-4-15(5-3-14)27(19,25)26/h2-5,13H,1,6-7,9-12H2,(H,20,23)(H,21,24)(H2,19,25,26)