Chem
J-GLOBAL ID：200907026556688450   Nikkaji number：J10.584H

Thiopurinol

チオプリノール
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C5H4N4S
Molecular formula furigana： C5-H4-N4-S
Molecular weight： 152.180
InChI： InChI=1S/C5H4N4S/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H,(H2,6,7,8,9,10)
InChI key： PYAOPMWCFSVFOT-UHFFFAOYSA-N
SMILES： S=c1[nH]cnc2[nH]ncc12
Systematic name  (4)：
  • 1,5-ジヒドロ-4H-ピラゾロ[3,4-d]ピリミジン-4-チオン
  • 1H-ピラゾロ[3,4-d]ピリミジン-4-チオール
  • 1H,4H,5H-ピラゾロ[3,4-d]ピリミジン-4-チオン
  • 1H,4H,5H-pyrazolo[3,4-d]pyrimidine-4-thione
Other name (4)：
  • チオプリノール
  • Thiopurinol
  • 1,5-Dihydro-4H-pyrazolo[3,4-d]pyrimidine-4-thione
  • 1H-Pyrazolo[3,4-d]pyrimidine-4-thiol
CAS registry number： 5334-23-6
Regulation number (1)：
  • EINECS2262518
KEGG DRUG： D07278
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