2-(3-methylphenyl)-6-(trifluoromethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-(3-methylphenyl)-6-(trifluoromethyl)-1H-pyrimidin-4-one Openeye Name: 2-(m-tolyl)-6-(trifluoromethyl)-1H-pyrimidin-4-one CAS Name: 2-(3-methylphenyl)-6-(trifluoromethyl)-1H-pyrimidin-4-one IUPAC Name: 2-(3-methylphenyl)-6-(trifluoromethyl)-1H-pyrimidin-4-one Traditional Name: 2-(m-tolyl)-6-(trifluoromethyl)-1H-pyrimidin-4-one Formula: C12H9F3N2O MolecularWeight: 254.20787

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=O)C=C(N2)C(F)(F)F

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=O)C=C(N2)C(F)(F)F

InChI

InChI=1S/C12H9F3N2O/c1-7-3-2-4-8(5-7)11-16-9(12(13,14)15)6-10(18)17-11/h2-6H,1H3,(H,16,17,18)