N-[2-(diethylamino)-3-methyl-butyl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-[2-(diethylamino)-3-methyl-butyl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[2-(diethylamino)-3-methyl-butyl]piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[2-(diethylamino)-3-methylbutyl]-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[2-(diethylamino)-3-methylbutyl]piperidine-3-carboxamide Traditional Name: 1-besyl-N-[2-(diethylamino)-3-methyl-butyl]nipecotamide Formula: C21H35N3O3S MolecularWeight: 409.5859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=CC=C2)C(C)C

Isomeric SMILES

CCN(CC)C(CNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=CC=C2)C(C)C

InChI

InChI=1S/C21H35N3O3S/c1-5-23(6-2)20(17(3)4)15-22-21(25)18-11-10-14-24(16-18)28(26,27)19-12-8-7-9-13-19/h7-9,12-13,17-18,20H,5-6,10-11,14-16H2,1-4H3,(H,22,25)