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Substance Name: Spebrutinib besylate [USAN]
RN: 1360053-81-1
UNII: RC3ET192UJ
InChIKey: ABSXPNGWJFAPRT-UHFFFAOYSA-N

Note

  • Inhibits Bruton's tyrosine kinase.

Classification Code

  • Treatment of Hematological Malignancies and Autoimmune Diseases

Molecular Formula

  • C22-H22-F-N5-O3.C6-H6-O3-S

Molecular Weight

  • 581.6222
 
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Names and Synonyms

Name of Substance

  • Spebrutinib besylate [USAN]

Synonyms

  • CC-292
  • N-(3-((5-fluoro-2-((4-(2-methoxyethoxy)phenyl)amino)pyrimidin-4-yl)amino)phenyl)prop-2-enamide benzenesulfonate
  • Spebrutinib besylate
  • UNII-RC3ET192UJ

Systematic Name

  • 2-Propenamide, N-(3-((5-fluoro-2-((4-(2-methoxyethoxy)phenyl)amino)-4-pyrimidinyl)amino)phenyl)-, benzenesulfonate (1:1)

Registry Numbers

CAS Registry Number

  • 1360053-81-1

FDA UNII

  • RC3ET192UJ

System Generated Number

  • 1360053811

Structure Descriptors

InChI

1S/C22H22FN5O3.C6H6O3S/c1-3-20(29)25-16-5-4-6-17(13-16)26-21-19(23)14-24-22(28-21)27-15-7-9-18(10-8-15)31-12-11-30-2;7-10(8,9)6-4-2-1-3-5-6/h3-10,13-14H,1,11-12H2,2H3,(H,25,29)(H2,24,26,27,28);1-5H,(H,7,8,9)

InChIKey

ABSXPNGWJFAPRT-UHFFFAOYSA-N

Smiles

COCCOc1ccc(cc1)Nc2ncc(c(n2)Nc3cccc(c3)NC(=O)C=C)F.c1ccc(cc1)S(=O)(=O)O