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

Systemtic Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[[3-(methylcarbamoyl)phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[[3-(methylcarbamoyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[[3-(methylcarbamoyl)phenyl]methyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[3-(methylcarbamoyl)benzyl]isonipecotamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4S/c1-22-20(25)18-7-5-6-16(14-18)15-23-21(26)17-10-12-24(13-11-17)29(27,28)19-8-3-2-4-9-19/h2-9,14,17H,10-13,15H2,1H3,(H,22,25)(H,23,26)