2-[(6-fluoranylquinolin-2-yl)methyl]-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one

Systemtic Name: 2-[(6-fluoranylquinolin-2-yl)methyl]-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Openeye Name: 4-(4-fluorophenyl)-2-[(6-fluoro-2-quinolyl)methyl]-5-(4-methylsulfonylphenyl)pyridazin-3-one CAS Name: 4-(4-fluorophenyl)-2-[(6-fluoro-2-quinolinyl)methyl]-5-(4-methylsulfonylphenyl)-3-pyridazinone IUPAC Name: 4-(4-fluorophenyl)-2-[(6-fluoroquinolin-2-yl)methyl]-5-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 4-(4-fluorophenyl)-2-[(6-fluoro-2-quinolyl)methyl]-5-(4-mesylphenyl)pyridazin-3-one Formula: C27H19F2N3O3S MolecularWeight: 503.519866

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)CC3=NC4=C(C=C3)C=C(C=C4)F)C5=CC=C(C=C5)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)CC3=NC4=C(C=C3)C=C(C=C4)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H19F2N3O3S/c1-36(34,35)23-11-5-17(6-12-23)24-15-30-32(27(33)26(24)18-2-7-20(28)8-3-18)16-22-10-4-19-14-21(29)9-13-25(19)31-22/h2-15H,16H2,1H3