N-[[3-(methylcarbamoyl)phenyl]methyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(methylcarbamoyl)benzyl]-1-(3-pyridylsulfonyl)isonipecotamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C20H24N4O4S/c1-21-19(25)17-5-2-4-15(12-17)13-23-20(26)16-7-10-24(11-8-16)29(27,28)18-6-3-9-22-14-18/h2-6,9,12,14,16H,7-8,10-11,13H2,1H3,(H,21,25)(H,23,26)