2-[(4-chloranyl-2-fluoranyl-phenyl)amino]-3-ethyl-6-(trifluoromethyl)pyrimidin-4-one

Systemtic Name: 2-[(4-chloranyl-2-fluoranyl-phenyl)amino]-3-ethyl-6-(trifluoromethyl)pyrimidin-4-one Openeye Name: 2-(4-chloro-2-fluoro-anilino)-3-ethyl-6-(trifluoromethyl)pyrimidin-4-one CAS Name: 2-(4-chloro-2-fluoroanilino)-3-ethyl-6-(trifluoromethyl)-4-pyrimidinone IUPAC Name: 2-(4-chloro-2-fluoroanilino)-3-ethyl-6-(trifluoromethyl)pyrimidin-4-one Traditional Name: 2-(4-chloro-2-fluoro-anilino)-3-ethyl-6-(trifluoromethyl)pyrimidin-4-one Formula: C13H10ClF4N3O MolecularWeight: 335.684613

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C=C(N=C1NC2=C(C=C(C=C2)Cl)F)C(F)(F)F

Isomeric SMILES

CCN1C(=O)C=C(N=C1NC2=C(C=C(C=C2)Cl)F)C(F)(F)F

InChI

InChI=1S/C13H10ClF4N3O/c1-2-21-11(22)6-10(13(16,17)18)20-12(21)19-9-4-3-7(14)5-8(9)15/h3-6H,2H2,1H3,(H,19,20)