6-fluoranyl-1-[(4-fluorophenyl)methyl]-3-(3-methylphenyl)sulfonyl-7-piperidin-1-yl-quinolin-4-one

Systemtic Name: 6-fluoranyl-1-[(4-fluorophenyl)methyl]-3-(3-methylphenyl)sulfonyl-7-piperidin-1-yl-quinolin-4-one Openeye Name: 6-fluoro-1-[(4-fluorophenyl)methyl]-3-(m-tolylsulfonyl)-7-(1-piperidyl)quinolin-4-one CAS Name: 6-fluoro-1-[(4-fluorophenyl)methyl]-3-(3-methylphenyl)sulfonyl-7-(1-piperidinyl)-4-quinolinone IUPAC Name: 6-fluoro-1-[(4-fluorophenyl)methyl]-3-(3-methylphenyl)sulfonyl-7-piperidin-1-ylquinolin-4-one Traditional Name: 6-fluoro-1-(4-fluorobenzyl)-3-(m-tolylsulfonyl)-7-piperidino-4-quinolone Formula: C28H26F2N2O3S MolecularWeight: 508.579446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)C2=CN(C3=CC(=C(C=C3C2=O)F)N4CCCCC4)CC5=CC=C(C=C5)F

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)C2=CN(C3=CC(=C(C=C3C2=O)F)N4CCCCC4)CC5=CC=C(C=C5)F

InChI

InChI=1S/C28H26F2N2O3S/c1-19-6-5-7-22(14-19)36(34,35)27-18-32(17-20-8-10-21(29)11-9-20)25-16-26(31-12-3-2-4-13-31)24(30)15-23(25)28(27)33/h5-11,14-16,18H,2-4,12-13,17H2,1H3