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

Systemtic Name: methyl 2-phenylazanyl-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: methyl 2-anilino-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-anilino-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-anilino-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-anilino-4-(trifluoromethyl)pyrimidine-5-carboxylic acid methyl ester Formula: C13H10F3N3O2 MolecularWeight: 297.23261

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10F3N3O2/c1-21-11(20)9-7-17-12(19-10(9)13(14,15)16)18-8-5-3-2-4-6-8/h2-7H,1H3,(H,17,18,19)