4-(4-fluorophenyl)-2-(1-methylcyclopentyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one

Systemtic Name: 4-(4-fluorophenyl)-2-(1-methylcyclopentyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Openeye Name: 4-(4-fluorophenyl)-2-(1-methylcyclopentyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one CAS Name: 4-(4-fluorophenyl)-2-(1-methylcyclopentyl)-5-(4-methylsulfonylphenyl)-3-pyridazinone IUPAC Name: 4-(4-fluorophenyl)-2-(1-methylcyclopentyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 4-(4-fluorophenyl)-5-(4-mesylphenyl)-2-(1-methylcyclopentyl)pyridazin-3-one Formula: C23H23FN2O3S MolecularWeight: 426.503723

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC1)N2C(=O)C(=C(C=N2)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=C(C=C4)F

Isomeric SMILES

CC1(CCCC1)N2C(=O)C(=C(C=N2)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H23FN2O3S/c1-23(13-3-4-14-23)26-22(27)21(17-5-9-18(24)10-6-17)20(15-25-26)16-7-11-19(12-8-16)30(2,28)29/h5-12,15H,3-4,13-14H2,1-2H3