5-(3-methylsulfonylphenyl)-4-phenyl-2-[2,2,2-tris(fluoranyl)ethyl]pyridazin-3-one

Systemtic Name: 5-(3-methylsulfonylphenyl)-4-phenyl-2-[2,2,2-tris(fluoranyl)ethyl]pyridazin-3-one Openeye Name: 5-(3-methylsulfonylphenyl)-4-phenyl-2-(2,2,2-trifluoroethyl)pyridazin-3-one CAS Name: 5-(3-methylsulfonylphenyl)-4-phenyl-2-(2,2,2-trifluoroethyl)-3-pyridazinone IUPAC Name: 5-(3-methylsulfonylphenyl)-4-phenyl-2-(2,2,2-trifluoroethyl)pyridazin-3-one Traditional Name: 5-(3-mesylphenyl)-4-phenyl-2-(2,2,2-trifluoroethyl)pyridazin-3-one Formula: C19H15F3N2O3S MolecularWeight: 408.39421

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15F3N2O3S/c1-28(26,27)15-9-5-8-14(10-15)16-11-23-24(12-19(20,21)22)18(25)17(16)13-6-3-2-4-7-13/h2-11H,12H2,1H3