6-fluoranyl-3-(4-methylphenyl)sulfonyl-7-[(3R)-3-methylpiperidin-1-yl]-1-propyl-quinolin-4-one

Systemtic Name: 6-fluoranyl-3-(4-methylphenyl)sulfonyl-7-[(3R)-3-methylpiperidin-1-yl]-1-propyl-quinolin-4-one Openeye Name: 6-fluoro-7-[(3R)-3-methyl-1-piperidyl]-1-propyl-3-(p-tolylsulfonyl)quinolin-4-one CAS Name: 6-fluoro-3-(4-methylphenyl)sulfonyl-7-[(3R)-3-methyl-1-piperidinyl]-1-propyl-4-quinolinone IUPAC Name: 6-fluoro-3-(4-methylphenyl)sulfonyl-7-[(3R)-3-methylpiperidin-1-yl]-1-propylquinolin-4-one Traditional Name: 6-fluoro-7-[(3R)-3-methylpiperidino]-1-propyl-3-tosyl-4-quinolone Formula: C25H29FN2O3S MolecularWeight: 456.572763

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCCC(C3)C)F)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCC[C@H](C3)C)F)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H29FN2O3S/c1-4-11-27-16-24(32(30,31)19-9-7-17(2)8-10-19)25(29)20-13-21(26)23(14-22(20)27)28-12-5-6-18(3)15-28/h7-10,13-14,16,18H,4-6,11-12,15H2,1-3H3/t18-/m1/s1