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

Systemtic Name: 5-chloranyl-2-[2-oxidanylidene-2-[[2-(trifluoromethyl)phenyl]amino]ethyl]sulfanyl-pyrimidine-4-carboxylate Openeye Name: 5-chloro-2-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-[[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]thio]-4-pyrimidinecarboxylate IUPAC Name: 5-chloro-2-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-[[2-keto-2-[2-(trifluoromethyl)anilino]ethyl]thio]pyrimidine-4-carboxylate Formula: C14H8ClF3N3O3S- MolecularWeight: 390.74483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9ClF3N3O3S/c15-8-5-19-13(21-11(8)12(23)24)25-6-10(22)20-9-4-2-1-3-7(9)14(16,17)18/h1-5H,6H2,(H,20,22)(H,23,24)/p-1