1-butyl-3-(2,5-dimethylphenyl)sulfonyl-6-fluoranyl-7-(4-methylpiperidin-1-yl)quinolin-4-one

Systemtic Name: 1-butyl-3-(2,5-dimethylphenyl)sulfonyl-6-fluoranyl-7-(4-methylpiperidin-1-yl)quinolin-4-one Openeye Name: 1-butyl-3-(2,5-dimethylphenyl)sulfonyl-6-fluoro-7-(4-methyl-1-piperidyl)quinolin-4-one CAS Name: 1-butyl-3-(2,5-dimethylphenyl)sulfonyl-6-fluoro-7-(4-methyl-1-piperidinyl)-4-quinolinone IUPAC Name: 1-butyl-3-(2,5-dimethylphenyl)sulfonyl-6-fluoro-7-(4-methylpiperidin-1-yl)quinolin-4-one Traditional Name: 1-butyl-3-(2,5-dimethylphenyl)sulfonyl-6-fluoro-7-(4-methylpiperidino)-4-quinolone Formula: C27H33FN2O3S MolecularWeight: 484.625923

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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=C(C=CC(=C4)C)C

Isomeric SMILES

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

InChI

InChI=1S/C27H33FN2O3S/c1-5-6-11-30-17-26(34(32,33)25-14-19(3)7-8-20(25)4)27(31)21-15-22(28)24(16-23(21)30)29-12-9-18(2)10-13-29/h7-8,14-18H,5-6,9-13H2,1-4H3