N'-hexanoyl-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbohydrazide

Systemtic Name: N'-hexanoyl-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbohydrazide Openeye Name: N'-hexanoyl-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbohydrazide CAS Name: N'-(1-oxohexyl)-5-phenyl-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinecarbohydrazide IUPAC Name: N'-hexanoyl-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbohydrazide Traditional Name: N'-caproyl-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbohydrazide Formula: C20H20F3N5O2 MolecularWeight: 419.40031

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NNC(=O)C1=NN2C(=CC(=NC2=C1)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CCCCCC(=O)NNC(=O)C1=NN2C(=CC(=NC2=C1)C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H20F3N5O2/c1-2-3-5-10-18(29)25-26-19(30)15-12-17-24-14(13-8-6-4-7-9-13)11-16(20(21,22)23)28(17)27-15/h4,6-9,11-12H,2-3,5,10H2,1H3,(H,25,29)(H,26,30)