butyl 5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: butyl 5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: butyl 5-(p-tolyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 5-(4-methylphenyl)-7-(trifluoromethyl)-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid butyl ester IUPAC Name: butyl 5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 5-(p-tolyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid butyl ester Formula: C19H18F3N3O2 MolecularWeight: 377.36033

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C2N=C(C=C(N2N=C1)C(F)(F)F)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCOC(=O)C1=C2N=C(C=C(N2N=C1)C(F)(F)F)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H18F3N3O2/c1-3-4-9-27-18(26)14-11-23-25-16(19(20,21)22)10-15(24-17(14)25)13-7-5-12(2)6-8-13/h5-8,10-11H,3-4,9H2,1-2H3