1-butyl-6-fluoranyl-7-(4-methylpiperidin-1-yl)-3-(phenylsulfonyl)quinolin-4-one

Systemtic Name: 1-butyl-6-fluoranyl-7-(4-methylpiperidin-1-yl)-3-(phenylsulfonyl)quinolin-4-one Openeye Name: 3-(benzenesulfonyl)-1-butyl-6-fluoro-7-(4-methyl-1-piperidyl)quinolin-4-one CAS Name: 3-(benzenesulfonyl)-1-butyl-6-fluoro-7-(4-methyl-1-piperidinyl)-4-quinolinone IUPAC Name: 3-(benzenesulfonyl)-1-butyl-6-fluoro-7-(4-methylpiperidin-1-yl)quinolin-4-one Traditional Name: 3-besyl-1-butyl-6-fluoro-7-(4-methylpiperidino)-4-quinolone Formula: C25H29FN2O3S MolecularWeight: 456.572763

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCC(CC3)C)F)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCC(CC3)C)F)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H29FN2O3S/c1-3-4-12-28-17-24(32(30,31)19-8-6-5-7-9-19)25(29)20-15-21(26)23(16-22(20)28)27-13-10-18(2)11-14-27/h5-9,15-18H,3-4,10-14H2,1-2H3