N-[3-(methylcarbamoyl)thiophen-2-yl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-[3-(methylcarbamoyl)thiophen-2-yl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[3-(methylcarbamoyl)-2-thienyl]piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[3-(methylcarbamoyl)-2-thiophenyl]-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[3-(methylcarbamoyl)thiophen-2-yl]piperidine-3-carboxamide Traditional Name: 1-besyl-N-[3-(methylcarbamoyl)-2-thienyl]nipecotamide Formula: C18H21N3O4S2 MolecularWeight: 407.50704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=C(SC=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CNC(=O)C1=C(SC=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H21N3O4S2/c1-19-17(23)15-9-11-26-18(15)20-16(22)13-6-5-10-21(12-13)27(24,25)14-7-3-2-4-8-14/h2-4,7-9,11,13H,5-6,10,12H2,1H3,(H,19,23)(H,20,22)