4-fluoranyl-N-[6-[4-(2-methylphenyl)carbonylpiperazin-1-yl]pyridin-3-yl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[6-[4-(2-methylphenyl)carbonylpiperazin-1-yl]pyridin-3-yl]benzenesulfonamide Openeye Name: 4-fluoro-N-[6-[4-(2-methylbenzoyl)piperazin-1-yl]-3-pyridyl]benzenesulfonamide CAS Name: 4-fluoro-N-[6-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]-3-pyridinyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[6-[4-(2-methylbenzoyl)piperazin-1-yl]pyridin-3-yl]benzenesulfonamide Traditional Name: 4-fluoro-N-[6-(4-o-toluoylpiperazino)-3-pyridyl]benzenesulfonamide Formula: C23H23FN4O3S MolecularWeight: 454.517123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H23FN4O3S/c1-17-4-2-3-5-21(17)23(29)28-14-12-27(13-15-28)22-11-8-19(16-25-22)26-32(30,31)20-9-6-18(24)7-10-20/h2-11,16,26H,12-15H2,1H3