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

Systemtic Name: pentyl 5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: pentyl 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 pentyl ester IUPAC Name: pentyl 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 amyl ester Formula: C20H20F3N3O2 MolecularWeight: 391.38691

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20F3N3O2/c1-3-4-5-10-28-19(27)15-12-24-26-17(20(21,22)23)11-16(25-18(15)26)14-8-6-13(2)7-9-14/h6-9,11-12H,3-5,10H2,1-2H3