5-(3-fluoranyl-4-methylsulfonyl-phenyl)-2,4-bis(4-fluorophenyl)pyridazin-3-one

Systemtic Name: 5-(3-fluoranyl-4-methylsulfonyl-phenyl)-2,4-bis(4-fluorophenyl)pyridazin-3-one Openeye Name: 5-(3-fluoro-4-methylsulfonyl-phenyl)-2,4-bis(4-fluorophenyl)pyridazin-3-one CAS Name: 5-(3-fluoro-4-methylsulfonylphenyl)-2,4-bis(4-fluorophenyl)-3-pyridazinone IUPAC Name: 5-(3-fluoro-4-methylsulfonylphenyl)-2,4-bis(4-fluorophenyl)pyridazin-3-one Traditional Name: 5-(3-fluoro-4-mesyl-phenyl)-2,4-bis(4-fluorophenyl)pyridazin-3-one Formula: C23H15F3N2O3S MolecularWeight: 456.43701

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H15F3N2O3S/c1-32(30,31)21-11-4-15(12-20(21)26)19-13-27-28(18-9-7-17(25)8-10-18)23(29)22(19)14-2-5-16(24)6-3-14/h2-13H,1H3