N-(4-methylpyridin-2-yl)-1-[3-(phenylsulfonylamino)phenyl]carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-methylpyridin-2-yl)-1-[3-(phenylsulfonylamino)phenyl]carbonyl-piperidine-4-carboxamide Openeye Name: 1-[3-(benzenesulfonamido)benzoyl]-N-(4-methyl-2-pyridyl)piperidine-4-carboxamide CAS Name: 1-[[3-(benzenesulfonamido)phenyl]-oxomethyl]-N-(4-methyl-2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: 1-[3-(benzenesulfonamido)benzoyl]-N-(4-methylpyridin-2-yl)piperidine-4-carboxamide Traditional Name: 1-[3-(benzenesulfonamido)benzoyl]-N-(4-methyl-2-pyridyl)isonipecotamide Formula: C25H26N4O4S MolecularWeight: 478.56334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)NC(=O)C2CCN(CC2)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC=C1)NC(=O)C2CCN(CC2)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H26N4O4S/c1-18-10-13-26-23(16-18)27-24(30)19-11-14-29(15-12-19)25(31)20-6-5-7-21(17-20)28-34(32,33)22-8-3-2-4-9-22/h2-10,13,16-17,19,28H,11-12,14-15H2,1H3,(H,26,27,30)