2-sulfanylidene-5-[[4-(trifluoromethyl)phenyl]methyl]-1H-pyrimidin-4-one

Systemtic Name: 2-sulfanylidene-5-[[4-(trifluoromethyl)phenyl]methyl]-1H-pyrimidin-4-one Openeye Name: 2-thioxo-5-[[4-(trifluoromethyl)phenyl]methyl]-1H-pyrimidin-4-one CAS Name: 2-sulfanylidene-5-[[4-(trifluoromethyl)phenyl]methyl]-1H-pyrimidin-4-one IUPAC Name: 2-sulfanylidene-5-[[4-(trifluoromethyl)phenyl]methyl]-1H-pyrimidin-4-one Traditional Name: 2-thioxo-5-[4-(trifluoromethyl)benzyl]-1H-pyrimidin-4-one Formula: C12H9F3N2OS MolecularWeight: 286.27287

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CNC(=S)NC2=O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CC2=CNC(=S)NC2=O)C(F)(F)F

InChI

InChI=1S/C12H9F3N2OS/c13-12(14,15)9-3-1-7(2-4-9)5-8-6-16-11(19)17-10(8)18/h1-4,6H,5H2,(H2,16,17,18,19)