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Substance Name: Pimodivir hydrochloride [USAN]
RN: 1777721-70-6
UNII: A256039515
InChIKey: WPLSKBKDOCXXMO-KIHJVYKPSA-N

Classification Code

  • Treatment of Influenza A

Molecular Formula

  • 2C20-H19-F2-N5-O2.2Cl-H.H2-O

Molecular Weight

  • 889.7348
 
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Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)

  • USA.gov
  • USA.gov Mob

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Names and Synonyms

Name of Substance

  • Pimodivir hydrochloride hemihydrate
  • Pimodivir hydrochloride [USAN]

Synonyms

  • Bicyclo(2.2.2)octane-2-carboxylic acid, 3-((5-fluoro-2-(5-fluoro-1H-pyrrolo(2,3-b)pyridin-3-yl)-4-pyrimidinyl)amino)-, hydrochloride, hydrate (2:2:1), (2S,3S)-
  • JNJ872 hydrochloride hemihydrate
  • Pimodivir hydrochloride
  • Pimodivir hydrochloride hemihydrate
  • UNII-A256039515

Registry Numbers

CAS Registry Number

  • 1777721-70-6

FDA UNII

  • A256039515

System Generated Number

  • 1777721706

Structure Descriptors

InChI

1S/2C20H19F2N5O2.2ClH.H2O/c2*21-11-5-12-13(7-24-17(12)23-6-11)18-25-8-14(22)19(27-18)26-16-10-3-1-9(2-4-10)15(16)20(28)29;;;/h2*5-10,15-16H,1-4H2,(H,23,24)(H,28,29)(H,25,26,27);2*1H;1H2/t2*9?,10?,15-,16-;;;/m00.../s1

InChIKey

WPLSKBKDOCXXMO-KIHJVYKPSA-N

Smiles

O.Cl.Cl.OC(=O)[C@H]1C2CCC(CC2)[C@@H]1Nc3nc(ncc3F)c4c[nH]c5ncc(F)cc45.OC(=O)[C@H]6C7CCC(CC7)[C@@H]6Nc8nc(ncc8F)c9c[nH]c%10ncc(F)cc9%10