3-(4-bromanyl-2-fluoranyl-phenyl)-2-methylsulfanyl-6-(trifluoromethyl)pyrimidin-4-one

Systemtic Name: 3-(4-bromanyl-2-fluoranyl-phenyl)-2-methylsulfanyl-6-(trifluoromethyl)pyrimidin-4-one Openeye Name: 3-(4-bromo-2-fluoro-phenyl)-2-methylsulfanyl-6-(trifluoromethyl)pyrimidin-4-one CAS Name: 3-(4-bromo-2-fluorophenyl)-2-(methylthio)-6-(trifluoromethyl)-4-pyrimidinone IUPAC Name: 3-(4-bromo-2-fluorophenyl)-2-methylsulfanyl-6-(trifluoromethyl)pyrimidin-4-one Traditional Name: 3-(4-bromo-2-fluoro-phenyl)-2-(methylthio)-6-(trifluoromethyl)pyrimidin-4-one Formula: C12H7BrF4N2OS MolecularWeight: 383.159393

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CC(=O)N1C2=C(C=C(C=C2)Br)F)C(F)(F)F

Isomeric SMILES

CSC1=NC(=CC(=O)N1C2=C(C=C(C=C2)Br)F)C(F)(F)F

InChI

InChI=1S/C12H7BrF4N2OS/c1-21-11-18-9(12(15,16)17)5-10(20)19(11)8-3-2-6(13)4-7(8)14/h2-5H,1H3