N-[6-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]pyridin-3-yl]-3-methyl-benzenesulfonamide

Systemtic Name: N-[6-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]pyridin-3-yl]-3-methyl-benzenesulfonamide Openeye Name: N-[6-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-3-pyridyl]-3-methyl-benzenesulfonamide CAS Name: N-[6-[4-[(4-fluorophenyl)methyl]-1-piperazinyl]-3-pyridinyl]-3-methylbenzenesulfonamide IUPAC Name: N-[6-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]pyridin-3-yl]-3-methylbenzenesulfonamide Traditional Name: N-[6-[4-(4-fluorobenzyl)piperazino]-3-pyridyl]-3-methyl-benzenesulfonamide Formula: C23H25FN4O2S MolecularWeight: 440.533603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C23H25FN4O2S/c1-18-3-2-4-22(15-18)31(29,30)26-21-9-10-23(25-16-21)28-13-11-27(12-14-28)17-19-5-7-20(24)8-6-19/h2-10,15-16,26H,11-14,17H2,1H3