4-fluoranyl-N-[3-[4-(4-pyridin-2-ylpiperazin-1-ium-1-yl)piperidin-1-yl]phenyl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[3-[4-(4-pyridin-2-ylpiperazin-1-ium-1-yl)piperidin-1-yl]phenyl]benzenesulfonamide Openeye Name: 4-fluoro-N-[3-[4-[4-(2-pyridyl)piperazin-1-ium-1-yl]-1-piperidyl]phenyl]benzenesulfonamide CAS Name: 4-fluoro-N-[3-[4-[4-(2-pyridinyl)-1-piperazin-1-iumyl]-1-piperidinyl]phenyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[3-[4-(4-pyridin-2-ylpiperazin-1-ium-1-yl)piperidin-1-yl]phenyl]benzenesulfonamide Traditional Name: 4-fluoro-N-[3-[4-[4-(2-pyridyl)piperazin-1-ium-1-yl]piperidino]phenyl]benzenesulfonamide Formula: C26H31FN5O2S+ MolecularWeight: 496.620043

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+]2CCN(CC2)C3=CC=CC=N3)C4=CC(=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCC1[NH+]2CCN(CC2)C3=CC=CC=N3)C4=CC(=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H30FN5O2S/c27-21-7-9-25(10-8-21)35(33,34)29-22-4-3-5-24(20-22)30-14-11-23(12-15-30)31-16-18-32(19-17-31)26-6-1-2-13-28-26/h1-10,13,20,23,29H,11-12,14-19H2/p+1