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

Systemtic Name: 6-methyl-2-[2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl]sulfanyl-pyrimidin-4-olate Openeye Name: 6-methyl-2-[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]sulfanyl-pyrimidin-4-olate CAS Name: 6-methyl-2-[[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]thio]-4-pyrimidinolate IUPAC Name: 6-methyl-2-[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]sulfanylpyrimidin-4-olate Traditional Name: 2-[[2-keto-2-[4-(trifluoromethoxy)anilino]ethyl]thio]-6-methyl-pyrimidin-4-olate Formula: C14H11F3N3O3S- MolecularWeight: 358.31565

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12F3N3O3S/c1-8-6-11(21)20-13(18-8)24-7-12(22)19-9-2-4-10(5-3-9)23-14(15,16)17/h2-6H,7H2,1H3,(H,19,22)(H,18,20,21)/p-1