6-fluoranyl-3-(3-methylphenyl)sulfonyl-7-(4-methylpiperidin-1-yl)-1-(phenylmethyl)quinolin-4-one

Systemtic Name: 6-fluoranyl-3-(3-methylphenyl)sulfonyl-7-(4-methylpiperidin-1-yl)-1-(phenylmethyl)quinolin-4-one Openeye Name: 1-benzyl-6-fluoro-7-(4-methyl-1-piperidyl)-3-(m-tolylsulfonyl)quinolin-4-one CAS Name: 6-fluoro-3-(3-methylphenyl)sulfonyl-7-(4-methyl-1-piperidinyl)-1-(phenylmethyl)-4-quinolinone IUPAC Name: 1-benzyl-6-fluoro-3-(3-methylphenyl)sulfonyl-7-(4-methylpiperidin-1-yl)quinolin-4-one Traditional Name: 1-benzyl-6-fluoro-7-(4-methylpiperidino)-3-(m-tolylsulfonyl)-4-quinolone Formula: C29H29FN2O3S MolecularWeight: 504.615563

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)S(=O)(=O)C4=CC=CC(=C4)C)CC5=CC=CC=C5)F

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)S(=O)(=O)C4=CC=CC(=C4)C)CC5=CC=CC=C5)F

InChI

InChI=1S/C29H29FN2O3S/c1-20-11-13-31(14-12-20)27-17-26-24(16-25(27)30)29(33)28(19-32(26)18-22-8-4-3-5-9-22)36(34,35)23-10-6-7-21(2)15-23/h3-10,15-17,19-20H,11-14,18H2,1-2H3