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

Systemtic Name: 2-sulfanylidene-5-[[2-(trifluoromethyl)pyrimidin-5-yl]methyl]-1H-pyrimidin-4-one Openeye Name: 2-thioxo-5-[[2-(trifluoromethyl)pyrimidin-5-yl]methyl]-1H-pyrimidin-4-one CAS Name: 2-sulfanylidene-5-[[2-(trifluoromethyl)-5-pyrimidinyl]methyl]-1H-pyrimidin-4-one IUPAC Name: 2-sulfanylidene-5-[[2-(trifluoromethyl)pyrimidin-5-yl]methyl]-1H-pyrimidin-4-one Traditional Name: 2-thioxo-5-[[2-(trifluoromethyl)pyrimidin-5-yl]methyl]-1H-pyrimidin-4-one Formula: C10H7F3N4OS MolecularWeight: 288.24899

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)NC(=S)N1)CC2=CN=C(N=C2)C(F)(F)F

Isomeric SMILES

C1=C(C(=O)NC(=S)N1)CC2=CN=C(N=C2)C(F)(F)F

InChI

InChI=1S/C10H7F3N4OS/c11-10(12,13)8-14-2-5(3-15-8)1-6-4-16-9(19)17-7(6)18/h2-4H,1H2,(H2,16,17,18,19)