2-[3,4-bis(fluoranyl)phenyl]-4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one

Systemtic Name: 2-[3,4-bis(fluoranyl)phenyl]-4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Openeye Name: 2-(3,4-difluorophenyl)-5-(4-methylsulfonylphenyl)-4-(p-tolyl)pyridazin-3-one CAS Name: 2-(3,4-difluorophenyl)-4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-3-pyridazinone IUPAC Name: 2-(3,4-difluorophenyl)-4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 2-(3,4-difluorophenyl)-5-(4-mesylphenyl)-4-(p-tolyl)pyridazin-3-one Formula: C24H18F2N2O3S MolecularWeight: 452.473126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C=NN(C2=O)C3=CC(=C(C=C3)F)F)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C=NN(C2=O)C3=CC(=C(C=C3)F)F)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C24H18F2N2O3S/c1-15-3-5-17(6-4-15)23-20(16-7-10-19(11-8-16)32(2,30)31)14-27-28(24(23)29)18-9-12-21(25)22(26)13-18/h3-14H,1-2H3