(5E)-1-methyl-6-oxidanylidene-2-sulfanylidene-5-[[4-(trifluoromethyl)phenyl]methylidene]pyrimidin-4-olate

Systemtic Name: (5E)-1-methyl-6-oxidanylidene-2-sulfanylidene-5-[[4-(trifluoromethyl)phenyl]methylidene]pyrimidin-4-olate Openeye Name: (5E)-1-methyl-6-oxo-2-thioxo-5-[[4-(trifluoromethyl)phenyl]methylene]pyrimidin-4-olate CAS Name: (5E)-1-methyl-6-oxo-2-sulfanylidene-5-[[4-(trifluoromethyl)phenyl]methylidene]-4-pyrimidinolate IUPAC Name: (5E)-1-methyl-6-oxo-2-sulfanylidene-5-[[4-(trifluoromethyl)phenyl]methylidene]pyrimidin-4-olate Traditional Name: (5E)-6-keto-1-methyl-2-thioxo-5-[4-(trifluoromethyl)benzylidene]pyrimidin-4-olate Formula: C13H8F3N2O2S- MolecularWeight: 313.27503

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC=C(C=C2)C(F)(F)F)C(=NC1=S)[O-]

Isomeric SMILES

CN1C(=O)/C(=C/C2=CC=C(C=C2)C(F)(F)F)/C(=NC1=S)[O-]

InChI

InChI=1S/C13H9F3N2O2S/c1-18-11(20)9(10(19)17-12(18)21)6-7-2-4-8(5-3-7)13(14,15)16/h2-6H,1H3,(H,17,19,21)/p-1/b9-6+