ethyl 2-[5-methyl-7-oxidanylidene-3-phenyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-6-yl]ethanoate

Systemtic Name: ethyl 2-[5-methyl-7-oxidanylidene-3-phenyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-6-yl]ethanoate Openeye Name: ethyl 2-[5-methyl-7-oxo-3-phenyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-6-yl]acetate CAS Name: 2-[5-methyl-7-oxo-3-phenyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-6-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-methyl-7-oxo-3-phenyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-6-yl]acetate Traditional Name: 2-[7-keto-5-methyl-3-phenyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-6-yl]acetic acid ethyl ester Formula: C18H16F3N3O3 MolecularWeight: 379.33315

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(N=C2C(=C(NN2C1=O)C(F)(F)F)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)CC1=C(N=C2C(=C(NN2C1=O)C(F)(F)F)C3=CC=CC=C3)C

InChI

InChI=1S/C18H16F3N3O3/c1-3-27-13(25)9-12-10(2)22-16-14(11-7-5-4-6-8-11)15(18(19,20)21)23-24(16)17(12)26/h4-8,23H,3,9H2,1-2H3