N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[[2-(1-imidazolylmethyl)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]piperidine-3-carboxamide Traditional Name: 1-besyl-N-[2-(imidazol-1-ylmethyl)benzyl]nipecotamide Formula: C23H26N4O3S MolecularWeight: 438.54254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3CN4C=CN=C4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3CN4C=CN=C4

InChI

InChI=1S/C23H26N4O3S/c28-23(25-15-19-7-4-5-8-20(19)16-26-14-12-24-18-26)21-9-6-13-27(17-21)31(29,30)22-10-2-1-3-11-22/h1-5,7-8,10-12,14,18,21H,6,9,13,15-17H2,(H,25,28)