5-chloranyl-2-[2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl]sulfanyl-pyrimidine-4-carboxylate

Systemtic Name: 5-chloranyl-2-[2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl]sulfanyl-pyrimidine-4-carboxylate Openeye Name: 5-chloro-2-[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]sulfanyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-[[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]thio]-4-pyrimidinecarboxylate IUPAC Name: 5-chloro-2-[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]sulfanylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-[[2-keto-2-[4-(trifluoromethoxy)anilino]ethyl]thio]pyrimidine-4-carboxylate Formula: C14H8ClF3N3O4S- MolecularWeight: 406.74423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CSC2=NC=C(C(=N2)C(=O)[O-])Cl)OC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CSC2=NC=C(C(=N2)C(=O)[O-])Cl)OC(F)(F)F

InChI

InChI=1S/C14H9ClF3N3O4S/c15-9-5-19-13(21-11(9)12(23)24)26-6-10(22)20-7-1-3-8(4-2-7)25-14(16,17)18/h1-5H,6H2,(H,20,22)(H,23,24)/p-1