2-(4-Bromo-2-fluoro-5-nitrophenyl)-1,2-dihydro-5-methyl-3H-1,2,4-triazol-3-one

CAS Registry Number®

100563-50-6

CAS Name

2-(4-Bromo-2-fluoro-5-nitrophenyl)-1,2-dihydro-5-methyl-3H-1,2,4-triazol-3-one

Molecular Formula

C9H6BrFN4O3

Molecular Mass

317.07

Cite this Page

2-(4-Bromo-2-fluoro-5-nitrophenyl)-1,2-dihydro-5-methyl-3H-1,2,4-triazol-3-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=100563-50-6 (retrieved 2024-11-22) (CAS RN: 100563-50-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H6BrFN4O3/c1-4-12-9(16)14(13-4)8-3-7(15(17)18)5(10)2-6(8)11/h2-3H,1H3,(H,12,13,16)

InChIKey

InChIKey=WXMYAHCQEDYPBH-UHFFFAOYSA-N

SMILES

FC=1C(=CC(N(=O)=O)=C(Br)C1)N2C(=O)NC(C)=N2

Canonical SMILES

O=C1NC(=NN1C=2C=C(C(Br)=CC2F)N(=O)=O)C

Other Names for this Substance

  • 3H-1,2,4-Triazol-3-one, 2-(4-bromo-2-fluoro-5-nitrophenyl)-1,2-dihydro-5-methyl-
  • 2-(4-Bromo-2-fluoro-5-nitrophenyl)-1,2-dihydro-5-methyl-3H-1,2,4-triazol-3-one

CAS INSIGHTSTM
Targeted protein degrader structure, illustration