N-[2-[4-(phenylmethyl)piperazin-1-yl]carbonylphenyl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[2-[4-(phenylmethyl)piperazin-1-yl]carbonylphenyl]-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[2-(4-benzylpiperazine-1-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-[2-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[2-(4-benzylpiperazine-1-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[2-(4-benzylpiperazine-1-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide Formula: C25H24F3N3O3S MolecularWeight: 503.53657

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C25H24F3N3O3S/c26-25(27,28)20-9-6-10-21(17-20)35(33,34)29-23-12-5-4-11-22(23)24(32)31-15-13-30(14-16-31)18-19-7-2-1-3-8-19/h1-12,17,29H,13-16,18H2