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

Systemtic Name: 1-butyl-3-(4-ethylphenyl)sulfonyl-6-fluoranyl-7-(3-methylpiperidin-1-yl)quinolin-4-one Openeye Name: 1-butyl-3-(4-ethylphenyl)sulfonyl-6-fluoro-7-(3-methyl-1-piperidyl)quinolin-4-one CAS Name: 1-butyl-3-(4-ethylphenyl)sulfonyl-6-fluoro-7-(3-methyl-1-piperidinyl)-4-quinolinone IUPAC Name: 1-butyl-3-(4-ethylphenyl)sulfonyl-6-fluoro-7-(3-methylpiperidin-1-yl)quinolin-4-one Traditional Name: 1-butyl-3-(4-ethylphenyl)sulfonyl-6-fluoro-7-(3-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)N3CCCC(C3)C)F)S(=O)(=O)C4=CC=C(C=C4)CC

Isomeric SMILES

CCCCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCCC(C3)C)F)S(=O)(=O)C4=CC=C(C=C4)CC

InChI

InChI=1S/C27H33FN2O3S/c1-4-6-13-30-18-26(34(32,33)21-11-9-20(5-2)10-12-21)27(31)22-15-23(28)25(16-24(22)30)29-14-7-8-19(3)17-29/h9-12,15-16,18-19H,4-8,13-14,17H2,1-3H3