6-methyl-2-[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl]sulfanyl-pyrimidin-4-olate

Systemtic Name: 6-methyl-2-[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl]sulfanyl-pyrimidin-4-olate Openeye Name: 6-methyl-2-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]sulfanyl-pyrimidin-4-olate CAS Name: 6-methyl-2-[[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]thio]-4-pyrimidinolate IUPAC Name: 6-methyl-2-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]sulfanylpyrimidin-4-olate Traditional Name: 2-[[2-keto-2-[3-(trifluoromethyl)anilino]ethyl]thio]-6-methyl-pyrimidin-4-olate Formula: C14H11F3N3O2S- MolecularWeight: 342.31625

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=CC(=C2)C(F)(F)F)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=CC(=C2)C(F)(F)F)[O-]

InChI

InChI=1S/C14H12F3N3O2S/c1-8-5-11(21)20-13(18-8)23-7-12(22)19-10-4-2-3-9(6-10)14(15,16)17/h2-6H,7H2,1H3,(H,19,22)(H,18,20,21)/p-1