ethyl 4-[(4-ethoxyphenyl)amino]-2-(trifluoromethyl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(4-ethoxyphenyl)amino]-2-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-ethoxyanilino)-2-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 4-(4-ethoxyanilino)-2-(trifluoromethyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-ethoxyanilino)-2-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 4-(p-phenetidino)-2-(trifluoromethyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C16H16F3N3O3 MolecularWeight: 355.31175

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=NC=C2C(=O)OCC)C(F)(F)F

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=NC=C2C(=O)OCC)C(F)(F)F

InChI

InChI=1S/C16H16F3N3O3/c1-3-24-11-7-5-10(6-8-11)21-13-12(14(23)25-4-2)9-20-15(22-13)16(17,18)19/h5-9H,3-4H2,1-2H3,(H,20,21,22)