N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-(phenylsulfonyl)piperidine-2-carboxamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-(phenylsulfonyl)piperidine-2-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]piperidine-2-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[2-[(2-fluorophenyl)methylthio]ethyl]-2-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]piperidine-2-carboxamide Traditional Name: 1-besyl-N-[2-[(2-fluorobenzyl)thio]ethyl]pipecolinamide Formula: C21H25FN2O3S2 MolecularWeight: 436.563203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NCCSCC2=CC=CC=C2F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)NCCSCC2=CC=CC=C2F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25FN2O3S2/c22-19-11-5-4-8-17(19)16-28-15-13-23-21(25)20-12-6-7-14-24(20)29(26,27)18-9-2-1-3-10-18/h1-5,8-11,20H,6-7,12-16H2,(H,23,25)