methyl 2-(5-azanyl-4-cyano-pyrazol-1-yl)-4-(trifluoromethyl)pyrimidine-5-carboxylate

Systemtic Name: methyl 2-(5-azanyl-4-cyano-pyrazol-1-yl)-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: methyl 2-(5-amino-4-cyano-pyrazol-1-yl)-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-(5-amino-4-cyano-1-pyrazolyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(5-amino-4-cyanopyrazol-1-yl)-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-(5-amino-4-cyano-pyrazol-1-yl)-4-(trifluoromethyl)pyrimidine-5-carboxylic acid methyl ester Formula: C11H7F3N6O2 MolecularWeight: 312.20749

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(N=C1C(F)(F)F)N2C(=C(C=N2)C#N)N

Isomeric SMILES

COC(=O)C1=CN=C(N=C1C(F)(F)F)N2C(=C(C=N2)C#N)N

InChI

InChI=1S/C11H7F3N6O2/c1-22-9(21)6-4-17-10(19-7(6)11(12,13)14)20-8(16)5(2-15)3-18-20/h3-4H,16H2,1H3