3-chloranyl-4-fluoranyl-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]benzenesulfonamide

Systemtic Name: 3-chloranyl-4-fluoranyl-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]benzenesulfonamide Openeye Name: 3-chloro-4-fluoro-N-[[1-(3-pyridylmethyl)-4-piperidyl]methyl]benzenesulfonamide CAS Name: 3-chloro-4-fluoro-N-[[1-(3-pyridinylmethyl)-4-piperidinyl]methyl]benzenesulfonamide IUPAC Name: 3-chloro-4-fluoro-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]benzenesulfonamide Traditional Name: 3-chloro-4-fluoro-N-[[1-(3-pyridylmethyl)-4-piperidyl]methyl]benzenesulfonamide Formula: C18H21ClFN3O2S MolecularWeight: 397.894643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNS(=O)(=O)C2=CC(=C(C=C2)F)Cl)CC3=CN=CC=C3

Isomeric SMILES

C1CN(CCC1CNS(=O)(=O)C2=CC(=C(C=C2)F)Cl)CC3=CN=CC=C3

InChI

InChI=1S/C18H21ClFN3O2S/c19-17-10-16(3-4-18(17)20)26(24,25)22-12-14-5-8-23(9-6-14)13-15-2-1-7-21-11-15/h1-4,7,10-11,14,22H,5-6,8-9,12-13H2