N-(2-fluorophenyl)-3-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-(2-fluorophenyl)-3-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-(2-fluorophenyl)-3-[4-(4-pyridylmethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-(2-fluorophenyl)-3-[oxo-[4-(pyridin-4-ylmethyl)-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: N-(2-fluorophenyl)-3-[4-(pyridin-4-ylmethyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-(2-fluorophenyl)-3-[4-(4-pyridylmethyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C23H23FN4O3S MolecularWeight: 454.517123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=CC=C4F

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=CC=C4F

InChI

InChI=1S/C23H23FN4O3S/c24-21-6-1-2-7-22(21)26-32(30,31)20-5-3-4-19(16-20)23(29)28-14-12-27(13-15-28)17-18-8-10-25-11-9-18/h1-11,16,26H,12-15,17H2