1-butyl-3-(2,5-dimethylphenyl)sulfonyl-6-fluoranyl-7-morpholin-4-yl-quinolin-4-one

Systemtic Name: 1-butyl-3-(2,5-dimethylphenyl)sulfonyl-6-fluoranyl-7-morpholin-4-yl-quinolin-4-one Openeye Name: 1-butyl-3-(2,5-dimethylphenyl)sulfonyl-6-fluoro-7-morpholino-quinolin-4-one CAS Name: 1-butyl-3-(2,5-dimethylphenyl)sulfonyl-6-fluoro-7-(4-morpholinyl)-4-quinolinone IUPAC Name: 1-butyl-3-(2,5-dimethylphenyl)sulfonyl-6-fluoro-7-morpholin-4-ylquinolin-4-one Traditional Name: 1-butyl-3-(2,5-dimethylphenyl)sulfonyl-6-fluoro-7-morpholino-4-quinolone Formula: C25H29FN2O4S MolecularWeight: 472.572163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCOCC3)F)S(=O)(=O)C4=C(C=CC(=C4)C)C

Isomeric SMILES

CCCCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCOCC3)F)S(=O)(=O)C4=C(C=CC(=C4)C)C

InChI

InChI=1S/C25H29FN2O4S/c1-4-5-8-28-16-24(33(30,31)23-13-17(2)6-7-18(23)3)25(29)19-14-20(26)22(15-21(19)28)27-9-11-32-12-10-27/h6-7,13-16H,4-5,8-12H2,1-3H3