6-methyl-2-[2,2,2-tris(fluoranyl)ethanoylsulfanyl]pyrimidin-4-olate

Systemtic Name: 6-methyl-2-[2,2,2-tris(fluoranyl)ethanoylsulfanyl]pyrimidin-4-olate Openeye Name: 6-methyl-2-(2,2,2-trifluoroacetyl)sulfanyl-pyrimidin-4-olate CAS Name: 6-methyl-2-[(2,2,2-trifluoro-1-oxoethyl)thio]-4-pyrimidinolate IUPAC Name: 6-methyl-2-(2,2,2-trifluoroacetyl)sulfanylpyrimidin-4-olate Traditional Name: 6-methyl-2-[(2,2,2-trifluoroacetyl)thio]pyrimidin-4-olate Formula: C7H4F3N2O2S- MolecularWeight: 237.17907

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(=O)C(F)(F)F)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SC(=O)C(F)(F)F)[O-]

InChI

InChI=1S/C7H5F3N2O2S/c1-3-2-4(13)12-6(11-3)15-5(14)7(8,9)10/h2H,1H3,(H,11,12,13)/p-1