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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C1)N2C(=O)C(=C(C=N2)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=C(C=C4)F

Isomeric SMILES

CC1CCC(C1)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/c1-15-3-10-19(13-15)26-23(27)22(17-4-8-18(24)9-5-17)21(14-25-26)16-6-11-20(12-7-16)30(2,28)29/h4-9,11-12,14-15,19H,3,10,13H2,1-2H3