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Substance Name: Empesertib
RN: 1443763-60-7
UNII: 02Y3Z2756M
InChIKey: NRJKIOCCERLIDG-GOSISDBHSA-N

Molecular Formula

  • C29-H26-F-N5-O4-S

Molecular Weight

  • 559.6194
 
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Names and Synonyms

Name of Substance

  • Empesertib

Synonyms

  • (-)-BAY-1161909
  • (2R)-2-(4-Fluorophenyl)-N-(4-(2-((2-methoxy-4-(methylsulfonyl)phenyl)amino)(1,2,4)triazolo(1,5-a)pyridin-6-yl)phenyl)propanamide
  • (2R)-2-(4-Fluorophenyl)-N-(4-(2-((4-(methanesulfonyl)-2-methoxyphenyl)amino)(1,2,4)triazolo(1,5-a)pyridin-6-yl)phenyl)propanamide
  • (alphaR)-4-Fluoro-N-(4-(2-((2-methoxy-4-(methylsulfonyl)phenyl)amino)(1,2,4)triazolo(1,5-a)pyridin-6-yl)phenyl)-alpha-methylbenzeneacetamide
  • BAY 1161909
  • BAY-1161909
  • Benzeneacetamide, 4-fluoro-N-(4-(2-((2-methoxy-4-(methylsulfonyl)phenyl)amino)(1,2,4)triazolo(1,5-a)pyridin-6-yl)phenyl)-alpha-methyl-, (alphaR)-
  • Empesertib
  • Empesertib [INN]
  • Empesertib [WHO-DD]
  • MPS1-IN-5
  • UNII-02Y3Z2756M

Registry Numbers

CAS Registry Number

  • 1443763-60-7

FDA UNII

  • 02Y3Z2756M

System Generated Number

  • 1443763607

Structure Descriptors

InChI

1S/C29H26FN5O4S/c1-18(19-4-9-22(30)10-5-19)28(36)31-23-11-6-20(7-12-23)21-8-15-27-33-29(34-35(27)17-21)32-25-14-13-24(40(3,37)38)16-26(25)39-2/h4-18H,1-3H3,(H,31,36)(H,32,34)/t18-/m1/s1

InChIKey

NRJKIOCCERLIDG-GOSISDBHSA-N

Smiles

COc1cc(ccc1Nc2nc3ccc(cn3n2)c4ccc(NC(=O)[C@H](C)c5ccc(F)cc5)cc4)S(=O)(=O)C