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Substance Name: Bradanicline tosylate
RN: 1111942-11-0
UNII: 3821HT7KCR
InChIKey: YDJXUVIIXSFVOJ-OZYANKIXSA-N

Note

  • An alpha7 neuronal nicotinic receptor agonist.

Molecular Weight

  • 533.6459
 
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Names and Synonyms

Name of Substance

  • Bradanicline tosylate

Synonyms

  • 2-Benzofurancarboxamide, N-((2S,3R)-2-(3-pyridinylmethyl)-1-azabicyclo(2.2.2)oct-3-yl)-, 4-methylbenzenesulfonate (1:1)
  • TC 5619 tosylate
  • TC-5619 tosylate
  • UNII-3821HT7KCR

Registry Numbers

CAS Registry Number

  • 1111942-11-0

FDA UNII

  • 3821HT7KCR

System Generated Number

  • 1111942110

Structure Descriptors

InChI

1S/C22H23N3O2.C7H8O3S/c26-22(20-13-17-5-1-2-6-19(17)27-20)24-21-16-7-10-25(11-8-16)18(21)12-15-4-3-9-23-14-15;1-6-2-4-7(5-3-6)11(8,9)10/h1-6,9,13-14,16,18,21H,7-8,10-12H2,(H,24,26);2-5H,1H3,(H,8,9,10)/t18-,21+;/m0./s1

InChIKey

YDJXUVIIXSFVOJ-OZYANKIXSA-N

Smiles

Cc1ccc(cc1)S(=O)(=O)O.O=C(N[C@@H]2C3CCN(CC3)[C@H]2Cc4cccnc4)c5oc6ccccc6c5