N-(5-bromanylquinolin-8-yl)-5-tert-butyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: N-(5-bromanylquinolin-8-yl)-5-tert-butyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: N-(5-bromo-8-quinolyl)-5-tert-butyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: N-(5-bromo-8-quinolinyl)-5-tert-butyl-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-(5-bromoquinolin-8-yl)-5-tert-butyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: N-(5-bromo-8-quinolyl)-5-tert-butyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C21H17BrF3N5O MolecularWeight: 492.29179

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=CC(=NN2C(=C1)C(F)(F)F)C(=O)NC3=C4C(=C(C=C3)Br)C=CC=N4

Isomeric SMILES

CC(C)(C)C1=NC2=CC(=NN2C(=C1)C(F)(F)F)C(=O)NC3=C4C(=C(C=C3)Br)C=CC=N4

InChI

InChI=1S/C21H17BrF3N5O/c1-20(2,3)15-10-16(21(23,24)25)30-17(28-15)9-14(29-30)19(31)27-13-7-6-12(22)11-5-4-8-26-18(11)13/h4-10H,1-3H3,(H,27,31)