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Substance Name: Pyrabrom [USAN]
RN: 606-05-3
UNII: 360MH2GO0I
InChIKey: XMOLCXIDFCGXAR-UHFFFAOYSA-N

Classification Code

  • Antihistaminic

Molecular Weight

  • 544.451
 
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Names and Synonyms

Name of Substance

  • Pyrabrom [USAN]

Synonyms

  • 1H-Purine-2,6-dione, 8-bromo-3,7-dihydro-1,3-dimethyl, compd. with N-((4-methoxyphenyl)methyl)-N',N'-dimethyl-N-2-pyridinyl-1,2-ethanediamine (1:1)
  • 8-Bromotheophylline compound with 2-((2-(dimethylamino)ethyl)(p-methoxybenzyl)amino)pyridine (1:1)
  • NSC 14279
  • Pyrabrom
  • SMP 68-40
  • UNII-360MH2GO0I

Registry Numbers

CAS Registry Number

  • 606-05-3

FDA UNII

  • 360MH2GO0I

System Generated Number

  • 0000606053

Structure Descriptors

InChI

InChI=1S/C17H23N3O.C7H7BrN4O2/c1-19(2)12-13-20(17-6-4-5-11-18-17)14-15-7-9-16(21-3)10-8-15;1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14/h4-11H,12-14H2,1-3H3;1-2H3,(H,9,10)

InChIKey

XMOLCXIDFCGXAR-UHFFFAOYSA-N

Smiles

COc1ccc(CN(CCN(C)C)c2ccccn2)cc1.CN3C(=O)N(C)c4nc(Br)[nH]c4C3=O