Chem
J-GLOBAL ID:200907051491217174   Nikkaji number:J2.598.745D

3-(4-tert-Butylphenyl)-4H-1,2,4-triazole-5-thiol

3-(4-tert-ブチルフェニル)-4H-1,2,4-トリアゾール-5-チオール
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: C12H15N3S
Molecular formula furigana: C12-H15-N3-S
Molecular weight: 233.330
InChI: InChI=1S/C12H15N3S/c1-12(2,3)9-6-4-8(5-7-9)10-13-11(16)15-14-10/h4-7H,1-3H3,(H2,13,14,15,16)
InChI key: IOJOIOYNUDYUPU-UHFFFAOYSA-N
SMILES: CC(C)(C)c1ccc(cc1)c1nc(S)n[nH]1
Systematic name  (4):
  • 5-(4-tert-ブチルフェニル)-3-メルカプト-1H-1,2,4-トリアゾール
  • 3-(4-tert-ブチルフェニル)-4H-1,2,4-トリアゾール-5-チオール
  • 5-(4-tert-ブチルフェニル)-1H-1,2,4-トリアゾール-3-チオール
  • 5-(4-tert-butylphenyl)-1H-1,2,4-triazole-3-thiol
Other name (2):
  • 5-(4-tert-Butylphenyl)-3-mercapto-1H-1,2,4-triazole
  • 3-(4-tert-Butylphenyl)-4H-1,2,4-triazole-5-thiol
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