N-(5-bromanylpyridin-2-yl)-3-chloranyl-5-phenyl-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-8-ium-2-carboxamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-3-chloranyl-5-phenyl-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-8-ium-2-carboxamide Openeye Name: N-(5-bromo-2-pyridyl)-3-chloro-5-phenyl-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-8-ium-2-carboxamide CAS Name: N-(5-bromo-2-pyridinyl)-3-chloro-5-phenyl-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-8-ium-2-carboxamide IUPAC Name: N-(5-bromopyridin-2-yl)-3-chloro-5-phenyl-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-8-ium-2-carboxamide Traditional Name: N-(5-bromo-2-pyridyl)-3-chloro-5-phenyl-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-8-ium-2-carboxamide Formula: C19H11BrClF3N5O+ MolecularWeight: 497.67575

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=[N+]3C(=N2)C(=C(N3)C(=O)NC4=NC=C(C=C4)Br)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=[N+]3C(=N2)C(=C(N3)C(=O)NC4=NC=C(C=C4)Br)Cl)C(F)(F)F

InChI

InChI=1S/C19H10BrClF3N5O/c20-11-6-7-14(25-9-11)27-18(30)16-15(21)17-26-12(10-4-2-1-3-5-10)8-13(19(22,23)24)29(17)28-16/h1-9H,(H,25,27,30)/p+1