7-(azepan-1-yl)-1-ethyl-6-fluoranyl-3-(4-methylphenyl)sulfonyl-quinolin-4-one

Systemtic Name: 7-(azepan-1-yl)-1-ethyl-6-fluoranyl-3-(4-methylphenyl)sulfonyl-quinolin-4-one Openeye Name: 7-(azepan-1-yl)-1-ethyl-6-fluoro-3-(p-tolylsulfonyl)quinolin-4-one CAS Name: 7-(1-azepanyl)-1-ethyl-6-fluoro-3-(4-methylphenyl)sulfonyl-4-quinolinone IUPAC Name: 7-(azepan-1-yl)-1-ethyl-6-fluoro-3-(4-methylphenyl)sulfonylquinolin-4-one Traditional Name: 7-(azepan-1-yl)-1-ethyl-6-fluoro-3-tosyl-4-quinolone Formula: C24H27FN2O3S MolecularWeight: 442.546183

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCCCCC3)F)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCCCCC3)F)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C24H27FN2O3S/c1-3-26-16-23(31(29,30)18-10-8-17(2)9-11-18)24(28)19-14-20(25)22(15-21(19)26)27-12-6-4-5-7-13-27/h8-11,14-16H,3-7,12-13H2,1-2H3