4-(4-fluorophenyl)-2-[(1-methylcyclopropyl)methyl]-5-(4-methylsulfonylphenyl)pyridazin-3-one

Systemtic Name: 4-(4-fluorophenyl)-2-[(1-methylcyclopropyl)methyl]-5-(4-methylsulfonylphenyl)pyridazin-3-one Openeye Name: 4-(4-fluorophenyl)-2-[(1-methylcyclopropyl)methyl]-5-(4-methylsulfonylphenyl)pyridazin-3-one CAS Name: 4-(4-fluorophenyl)-2-[(1-methylcyclopropyl)methyl]-5-(4-methylsulfonylphenyl)-3-pyridazinone IUPAC Name: 4-(4-fluorophenyl)-2-[(1-methylcyclopropyl)methyl]-5-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 4-(4-fluorophenyl)-5-(4-mesylphenyl)-2-[(1-methylcyclopropyl)methyl]pyridazin-3-one Formula: C22H21FN2O3S MolecularWeight: 412.477143

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1)CN2C(=O)C(=C(C=N2)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=C(C=C4)F

Isomeric SMILES

CC1(CC1)CN2C(=O)C(=C(C=N2)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H21FN2O3S/c1-22(11-12-22)14-25-21(26)20(16-3-7-17(23)8-4-16)19(13-24-25)15-5-9-18(10-6-15)29(2,27)28/h3-10,13H,11-12,14H2,1-2H3