1-(2,1,3-benzoxadiazol-4-ylsulfonyl)-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-(2,1,3-benzoxadiazol-4-ylsulfonyl)-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-(2,1,3-benzoxadiazol-4-ylsulfonyl)-N-(p-tolylmethyl)piperidine-3-carboxamide CAS Name: 1-(2,1,3-benzoxadiazol-4-ylsulfonyl)-N-[(4-methylphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-(2,1,3-benzoxadiazol-4-ylsulfonyl)-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-benzofurazan-4-ylsulfonyl-N-(4-methylbenzyl)nipecotamide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC4=NON=C43

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC4=NON=C43

InChI

InChI=1S/C20H22N4O4S/c1-14-7-9-15(10-8-14)12-21-20(25)16-4-3-11-24(13-16)29(26,27)18-6-2-5-17-19(18)23-28-22-17/h2,5-10,16H,3-4,11-13H2,1H3,(H,21,25)