ethyl 2-phenylazanyl-4-(trifluoromethyl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-phenylazanyl-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-anilino-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-anilino-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-anilino-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-anilino-4-(trifluoromethyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C14H12F3N3O2 MolecularWeight: 311.25919

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1C(F)(F)F)NC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1C(F)(F)F)NC2=CC=CC=C2

InChI

InChI=1S/C14H12F3N3O2/c1-2-22-12(21)10-8-18-13(20-11(10)14(15,16)17)19-9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,18,19,20)