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

Systemtic Name: 3-(3,5-dimethylphenyl)sulfonyl-1-ethyl-6-fluoranyl-7-morpholin-4-yl-quinolin-4-one Openeye Name: 3-(3,5-dimethylphenyl)sulfonyl-1-ethyl-6-fluoro-7-morpholino-quinolin-4-one CAS Name: 3-(3,5-dimethylphenyl)sulfonyl-1-ethyl-6-fluoro-7-(4-morpholinyl)-4-quinolinone IUPAC Name: 3-(3,5-dimethylphenyl)sulfonyl-1-ethyl-6-fluoro-7-morpholin-4-ylquinolin-4-one Traditional Name: 3-(3,5-dimethylphenyl)sulfonyl-1-ethyl-6-fluoro-7-morpholino-4-quinolone Formula: C23H25FN2O4S MolecularWeight: 444.519003

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCOCC3)F)S(=O)(=O)C4=CC(=CC(=C4)C)C

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCOCC3)F)S(=O)(=O)C4=CC(=CC(=C4)C)C

InChI

InChI=1S/C23H25FN2O4S/c1-4-25-14-22(31(28,29)17-10-15(2)9-16(3)11-17)23(27)18-12-19(24)21(13-20(18)25)26-5-7-30-8-6-26/h9-14H,4-8H2,1-3H3