1-(phenylsulfonyl)-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-(phenylsulfonyl)-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[[2-(1-piperidylmethyl)phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[[2-(1-piperidinylmethyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[2-(piperidinomethyl)benzyl]isonipecotamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=CC=C2CNC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CC2=CC=CC=C2CNC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H33N3O3S/c29-25(21-13-17-28(18-14-21)32(30,31)24-11-3-1-4-12-24)26-19-22-9-5-6-10-23(22)20-27-15-7-2-8-16-27/h1,3-6,9-12,21H,2,7-8,13-20H2,(H,26,29)