Epacadostat

CAS Registry Number®

1204669-58-8
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CAS Name

Epacadostat

Molecular Formula

C11H13BrFN7O4S

Molecular Mass

438.23

Cite this Page

Epacadostat.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1204669-58-8 (retrieved 2024-07-21) (CAS RN: 1204669-58-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H13BrFN7O4S/c12-7-5-6(1-2-8(7)13)17-11(18-21)9-10(20-24-19-9)15-3-4-16-25(14,22)23/h1-2,5,16,21H,3-4H2,(H,15,20)(H,17,18)(H2,14,22,23)

InChIKey

InChIKey=FBKMWOJEPMPVTQ-UHFFFAOYSA-N

SMILES

C(\NC1=CC(Br)=C(F)C=C1)(=N\O)/C=2C(NCCNS(N)(=O)=O)=NON2

Canonical SMILES

O=S(=O)(N)NCCNC1=NON=C1C(=NO)NC2=CC=C(F)C(Br)=C2

Other Names for this Substance

  • 1,2,5-Oxadiazole-3-carboximidamide, 4-[[2-[(aminosulfonyl)amino]ethyl]amino]-N-(3-bromo-4-fluorophenyl)-N′-hydroxy-, [C(Z)]-
  • [C(Z)]-4-[[2-[(Aminosulfonyl)amino]ethyl]amino]-N-(3-bromo-4-fluorophenyl)-N′-hydroxy-1,2,5-oxadiazole-3-carboximidamide
  • INCB 024360
  • Epacadostat
  • ICBN 24360

Deleted or Replaced CAS Registry Numbers

1204669-37-3, 1220975-17-6