3-bromanyl-5-phenyl-N-(pyrimidin-5-ylmethyl)-1H-pyrazolo[1,5-a]pyridin-8-ium-7-amine

Systemtic Name: 3-bromanyl-5-phenyl-N-(pyrimidin-5-ylmethyl)-1H-pyrazolo[1,5-a]pyridin-8-ium-7-amine Openeye Name: 3-bromo-5-phenyl-N-(pyrimidin-5-ylmethyl)-1H-pyrazolo[1,5-a]pyridin-8-ium-7-amine CAS Name: 3-bromo-5-phenyl-N-(5-pyrimidinylmethyl)-1H-pyrazolo[1,5-a]pyridin-8-ium-7-amine IUPAC Name: 3-bromo-5-phenyl-N-(pyrimidin-5-ylmethyl)-1H-pyrazolo[1,5-a]pyridin-8-ium-7-amine Traditional Name: (3-bromo-5-phenyl-1H-pyrazolo[1,5-a]pyridin-8-ium-7-yl)-(5-pyrimidylmethyl)amine Formula: C18H15BrN5+ MolecularWeight: 381.2492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=[N+](C(=C2)NCC4=CN=CN=C4)NC=C3Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=[N+](C(=C2)NCC4=CN=CN=C4)NC=C3Br

InChI

InChI=1S/C18H14BrN5/c19-16-11-23-24-17(16)6-15(14-4-2-1-3-5-14)7-18(24)22-10-13-8-20-12-21-9-13/h1-9,11-12H,10H2,(H,22,23)/p+1