N-[2-[4-(phenylmethyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]-4-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: N-[2-[4-(phenylmethyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]-4-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-2-(3-pyridyl)ethyl]-4-(trifluoromethoxy)benzenesulfonamide CAS Name: N-[2-[4-(phenylmethyl)-1-piperazinyl]-2-(3-pyridinyl)ethyl]-4-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)-2-pyridin-3-ylethyl]-4-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-[2-(4-benzylpiperazino)-2-(3-pyridyl)ethyl]-4-(trifluoromethoxy)benzenesulfonamide Formula: C25H27F3N4O3S MolecularWeight: 520.56709

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(CNS(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(CNS(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F)C4=CN=CC=C4

InChI

InChI=1S/C25H27F3N4O3S/c26-25(27,28)35-22-8-10-23(11-9-22)36(33,34)30-18-24(21-7-4-12-29-17-21)32-15-13-31(14-16-32)19-20-5-2-1-3-6-20/h1-12,17,24,30H,13-16,18-19H2