N-[[1-(dimethylamino)cyclohexyl]methyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[[1-(dimethylamino)cyclohexyl]methyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[[1-(dimethylamino)cyclohexyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[[1-(dimethylamino)cyclohexyl]methyl]isonipecotamide Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1(CCCCC1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(C)C1(CCCCC1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H33N3O3S/c1-23(2)21(13-7-4-8-14-21)17-22-20(25)18-11-15-24(16-12-18)28(26,27)19-9-5-3-6-10-19/h3,5-6,9-10,18H,4,7-8,11-17H2,1-2H3,(H,22,25)