3,7-Dihydro-1,3-dimethyl-7-(methyl-d3)-1H-purine-2,6-dione

CAS Registry Number®

26351-04-2

CAS Name

3,7-Dihydro-1,3-dimethyl-7-(methyl-d3)-1H-purine-2,6-dione

Molecular Formula

C8H7D3N4O2

Cite this Page

3,7-Dihydro-1,3-dimethyl-7-(methyl-d3)-1H-purine-2,6-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=26351-04-2 (retrieved 2024-11-21) (CAS RN: 26351-04-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3/i1D3

InChIKey

InChIKey=RYYVLZVUVIJVGH-FIBGUPNXSA-N

SMILES

O=C1C2=C(N(C)C(=O)N1C)N=CN2C([2H])([2H])[2H]

Canonical SMILES

O=C1C2=C(N=CN2C)N(C(=O)N1C)C

Other Names for this Substance

  • 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-(methyl-d3)-
  • Caffeine-α7,α7,α7-d3
  • 3,7-Dihydro-1,3-dimethyl-7-(methyl-d3)-1H-purine-2,6-dione
  • 7-Trideuteromethyl-1,3-dimethylxanthine
  • 7,7,7-Caffeine-d3

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Deleted or Replaced CAS Registry Numbers

1500112-43-5

CAS INSIGHTSTM
Targeted protein degrader structure, illustration