3-bromanyl-5-(2-fluorophenyl)-N-(1-oxidanylpyridin-1-ium-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: 3-bromanyl-5-(2-fluorophenyl)-N-(1-oxidanylpyridin-1-ium-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 3-bromo-5-(2-fluorophenyl)-N-(1-hydroxypyridin-1-ium-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 3-bromo-5-(2-fluorophenyl)-N-(1-hydroxy-3-pyridin-1-iumyl)-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 3-bromo-5-(2-fluorophenyl)-N-(1-hydroxypyridin-1-ium-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: [3-bromo-5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]-(1-hydroxypyridin-1-ium-3-yl)amine Formula: C17H12BrFN5O+ MolecularWeight: 401.212483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=C(C=NN3C(=C2)NC4=C[N+](=CC=C4)O)Br)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=C(C=NN3C(=C2)NC4=C[N+](=CC=C4)O)Br)F

InChI

InChI=1S/C17H12BrFN5O/c18-13-9-20-24-16(21-11-4-3-7-23(25)10-11)8-15(22-17(13)24)12-5-1-2-6-14(12)19/h1-10,21,25H/q+1