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Substance Name: Deutivacaftor [USAN]
RN: 1413431-07-8
UNII: SHA6U5FJZL
InChIKey: PURKAOJPTOLRMP-ASMGOKTBSA-N

Classification Code

  • Treatment of Cystic Fibrosis

Molecular Formula

  • C24-H28-N2-O3

Molecular Weight

  • 401.552
 
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Names and Synonyms

Name of Substance

  • CTP-656
  • Deutivacaftor [USAN]

Synonyms

  • CTP-656
  • D9-ivacaftor
  • Deutivacaftor
  • Ivacaftor D9
  • UNII-SHA6U5FJZL
  • VX-561
  • WHO 10704

Registry Numbers

CAS Registry Number

  • 1413431-07-8

FDA UNII

  • SHA6U5FJZL

System Generated Number

  • 1413431078

Structure Descriptors

InChI

InChI=1S/C24H28N2O3/c1-23(2,3)16-11-17(24(4,5)6)20(27)12-19(16)26-22(29)15-13-25-18-10-8-7-9-14(18)21(15)28/h7-13,27H,1-6H3,(H,25,28)(H,26,29)/i4D3,5D3,6D3

InChIKey

PURKAOJPTOLRMP-ASMGOKTBSA-N

Smiles

[2H]C([2H])([2H])C(c1cc(c(NC(=O)C2=CNc3ccccc3C2=O)cc1O)C(C)(C)C)(C([2H])([2H])[2H])C([2H])([2H])[2H]