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 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
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
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
- 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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