methyl 2-[[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino]benzoate CAS Name: 2-[[oxo-[5-phenyl-7-(trifluoromethyl)-3-pyrazolo[1,5-a]pyrimidinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino]benzoate Traditional Name: 2-[[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino]benzoic acid methyl ester Formula: C22H15F3N4O3 MolecularWeight: 440.37471

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2=C3N=C(C=C(N3N=C2)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2=C3N=C(C=C(N3N=C2)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C22H15F3N4O3/c1-32-21(31)14-9-5-6-10-16(14)28-20(30)15-12-26-29-18(22(23,24)25)11-17(27-19(15)29)13-7-3-2-4-8-13/h2-12H,1H3,(H,28,30)