Chem
J-GLOBAL ID：200907092537382157
Nikkaji number：J1.032.910H
Yucasin
ユカシン
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： C8H6ClN3S
Molecular formula furigana： C8-H6-CL-N3-S
Molecular weight： 211.670
InChI：
InChI=1S/C8H6ClN3S/c9-6-3-1-5(2-4-6)7-10-8(13)12-11-7/h1-4H,(H2,10,11,12,13)
InChI key：
NHEHIODVWGKDFV-UHFFFAOYSA-N
SMILES：
Sc1nc(n[nH]1)c1ccc(Cl)cc1
Systematic name (3)：
- 3-(4-クロロフェニル)-1H-1,2,4-トリアゾール-5-チオール
- 5-(4-クロロフェニル)-4H-1,2,4-トリアゾール-3-チオール
- 3-(4-chlorophenyl)-1H-1,2,4-triazole-5-thiol
- 3-(4-Chlorophenyl)-1H-1,2,4-triazole-5-thiol
- 5-(4-Chlorophenyl)-4H-1,2,4-triazole-3-thiol
- ユカシン
- Yucasin
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