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

Systemtic Name: 3-(4-bromanyl-2-fluoranyl-phenyl)-2-(2,2-dimethoxyethylamino)-6-(trifluoromethyl)pyrimidin-4-one Openeye Name: 3-(4-bromo-2-fluoro-phenyl)-2-(2,2-dimethoxyethylamino)-6-(trifluoromethyl)pyrimidin-4-one CAS Name: 3-(4-bromo-2-fluorophenyl)-2-(2,2-dimethoxyethylamino)-6-(trifluoromethyl)-4-pyrimidinone IUPAC Name: 3-(4-bromo-2-fluorophenyl)-2-(2,2-dimethoxyethylamino)-6-(trifluoromethyl)pyrimidin-4-one Traditional Name: 3-(4-bromo-2-fluoro-phenyl)-2-(2,2-dimethoxyethylamino)-6-(trifluoromethyl)pyrimidin-4-one Formula: C15H14BrF4N3O3 MolecularWeight: 440.187573

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Descriptors Computed from Structure

Canonical SMILES:

COC(CNC1=NC(=CC(=O)N1C2=C(C=C(C=C2)Br)F)C(F)(F)F)OC

Isomeric SMILES

COC(CNC1=NC(=CC(=O)N1C2=C(C=C(C=C2)Br)F)C(F)(F)F)OC

InChI

InChI=1S/C15H14BrF4N3O3/c1-25-13(26-2)7-21-14-22-11(15(18,19)20)6-12(24)23(14)10-4-3-8(16)5-9(10)17/h3-6,13H,7H2,1-2H3,(H,21,22)