7-[bis(fluoranyl)methyl]-5-phenyl-N-pyridin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-8-ium-3-carboxamide

Systemtic Name: 7-[bis(fluoranyl)methyl]-5-phenyl-N-pyridin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-8-ium-3-carboxamide Openeye Name: 7-(difluoromethyl)-5-phenyl-N-(3-pyridyl)-1H-pyrazolo[1,5-a]pyrimidin-8-ium-3-carboxamide CAS Name: 7-(difluoromethyl)-5-phenyl-N-(3-pyridinyl)-1H-pyrazolo[1,5-a]pyrimidin-8-ium-3-carboxamide IUPAC Name: 7-(difluoromethyl)-5-phenyl-N-pyridin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-8-ium-3-carboxamide Traditional Name: 7-(difluoromethyl)-5-phenyl-N-(3-pyridyl)-1H-pyrazolo[1,5-a]pyrimidin-8-ium-3-carboxamide Formula: C19H14F2N5O+ MolecularWeight: 366.344166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=[N+]3C(=N2)C(=CN3)C(=O)NC4=CN=CC=C4)C(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=[N+]3C(=N2)C(=CN3)C(=O)NC4=CN=CC=C4)C(F)F

InChI

InChI=1S/C19H13F2N5O/c20-17(21)16-9-15(12-5-2-1-3-6-12)25-18-14(11-23-26(16)18)19(27)24-13-7-4-8-22-10-13/h1-11,17H,(H,24,27)/p+1