ethyl 7-[bis(fluoranyl)methyl]-5-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl 7-[bis(fluoranyl)methyl]-5-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: ethyl 7-(difluoromethyl)-5-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 7-(difluoromethyl)-5-phenyl-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 7-(difluoromethyl)-5-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C16H13F2N3O2 MolecularWeight: 317.290126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13F2N3O2/c1-2-23-16(22)11-9-19-21-13(14(17)18)8-12(20-15(11)21)10-6-4-3-5-7-10/h3-9,14H,2H2,1H3