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

Systemtic Name: 6-fluoranyl-1-[(3-fluorophenyl)methyl]-3-(4-methylphenyl)sulfonyl-7-pyrrolidin-1-yl-quinolin-4-one Openeye Name: 6-fluoro-1-[(3-fluorophenyl)methyl]-3-(p-tolylsulfonyl)-7-pyrrolidin-1-yl-quinolin-4-one CAS Name: 6-fluoro-1-[(3-fluorophenyl)methyl]-3-(4-methylphenyl)sulfonyl-7-(1-pyrrolidinyl)-4-quinolinone IUPAC Name: 6-fluoro-1-[(3-fluorophenyl)methyl]-3-(4-methylphenyl)sulfonyl-7-pyrrolidin-1-ylquinolin-4-one Traditional Name: 6-fluoro-1-(3-fluorobenzyl)-7-pyrrolidino-3-tosyl-4-quinolone Formula: C27H24F2N2O3S MolecularWeight: 494.552866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC(=C(C=C3C2=O)F)N4CCCC4)CC5=CC(=CC=C5)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC(=C(C=C3C2=O)F)N4CCCC4)CC5=CC(=CC=C5)F

InChI

InChI=1S/C27H24F2N2O3S/c1-18-7-9-21(10-8-18)35(33,34)26-17-31(16-19-5-4-6-20(28)13-19)24-15-25(30-11-2-3-12-30)23(29)14-22(24)27(26)32/h4-10,13-15,17H,2-3,11-12,16H2,1H3