6-(4-methylsulfonylphenyl)-5-phenyl-2-(trifluoromethyl)-1H-pyrimidin-4-one

Systemtic Name: 6-(4-methylsulfonylphenyl)-5-phenyl-2-(trifluoromethyl)-1H-pyrimidin-4-one Openeye Name: 6-(4-methylsulfonylphenyl)-5-phenyl-2-(trifluoromethyl)-1H-pyrimidin-4-one CAS Name: 6-(4-methylsulfonylphenyl)-5-phenyl-2-(trifluoromethyl)-1H-pyrimidin-4-one IUPAC Name: 6-(4-methylsulfonylphenyl)-5-phenyl-2-(trifluoromethyl)-1H-pyrimidin-4-one Traditional Name: 6-(4-mesylphenyl)-5-phenyl-2-(trifluoromethyl)-1H-pyrimidin-4-one Formula: C18H13F3N2O3S MolecularWeight: 394.36763

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C18H13F3N2O3S/c1-27(25,26)13-9-7-12(8-10-13)15-14(11-5-3-2-4-6-11)16(24)23-17(22-15)18(19,20)21/h2-10H,1H3,(H,22,23,24)