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Substance Name: Upadacitinib [USAN:INN]
RN: 1310726-60-3
UNII: 4RA0KN46E0
InChIKey: WYQFJHHDOKWSHR-MNOVXSKESA-N

Note

  • A JAK-1 inhibitor.

Classification Code

  • Treatment of Rheumatoid Arthritis and Crohn's Disease

Molecular Formula

  • C17-H19-F3-N6-O

Molecular Weight

  • 380.3721
 
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Names and Synonyms

Name of Substance

  • Upadacitinib [USAN:INN]

Synonyms

  • (3S,4R)-3-ethyl-4-(3H-imidazo(1,2-a)pyrrolo(2,3-e)pyrazin-8-yl)-N-(2,2,2- trifluoroethyl)pyrrolidine-1-carboxamide
  • ABT 494
  • ABT-494
  • UNII-4RA0KN46E0
  • Upadacitinib

Systematic Name

  • 1-Pyrrolidinecarboxamide, 3-ethyl-4-(3H-imidazo(1,2-a)pyrrolo(2,3-e)pyrazin-8-yl)-N-(2,2,2-trifluoroethyl)-, (3S,4R)-

Registry Numbers

CAS Registry Number

  • 1310726-60-3

FDA UNII

  • 4RA0KN46E0

System Generated Number

  • 1310726603

Structure Descriptors

InChI

1S/C17H19F3N6O/c1-2-10-7-25(16(27)24-9-17(18,19)20)8-11(10)13-5-22-14-6-23-15-12(26(13)14)3-4-21-15/h3-6,10-11,21H,2,7-9H2,1H3,(H,24,27)/t10-,11+/m1/s1

InChIKey

WYQFJHHDOKWSHR-MNOVXSKESA-N

Smiles

CC[C@@H]1CN(C[C@@H]1c2cnc3cnc4[nH]ccc4n23)C(=O)NCC(F)(F)F