N-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[2-(4-tert-butyl-2,6-dimethylphenyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[2-(4-tert-butyl-2,6-dimethylphenyl)ethyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]isonipecotamide Formula: C26H36N2O3S MolecularWeight: 456.64064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C)C(C)(C)C

InChI

InChI=1S/C26H36N2O3S/c1-19-17-22(26(3,4)5)18-20(2)24(19)11-14-27-25(29)21-12-15-28(16-13-21)32(30,31)23-9-7-6-8-10-23/h6-10,17-18,21H,11-16H2,1-5H3,(H,27,29)