Chem
J-GLOBAL ID：200907028410274860
Nikkaji number：J1.792.880E
3-(Benzylthio)-4-cyclohexyl-4H-1,2,4-triazole
3-(ベンジルチオ)-4-シクロヘキシル-4H-1,2,4-トリアゾール
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： C15H19N3S
Molecular formula furigana： C15-H19-N3-S
Molecular weight： 273.400
InChI：
InChI=1S/C15H19N3S/c1-3-7-13(8-4-1)11-19-15-17-16-12-18(15)14-9-5-2-6-10-14/h1,3-4,7-8,12,14H,2,5-6,9-11H2
InChI key：
HOJXCCDZJNGIGR-UHFFFAOYSA-N
SMILES：
C(Sc1nncn1C1CCCCC1)c1ccccc1
Systematic name (3)：
- 3-(ベンジルチオ)-4-シクロヘキシル-4H-1,2,4-トリアゾール
- 3-(ベンジルスルファニル)-4-シクロヘキシル-4H-1,2,4-トリアゾール
- 3-(benzylsulfanyl)-4-cyclohexyl-4H-1,2,4-triazole
- 3-(Benzylthio)-4-cyclohexyl-4H-1,2,4-triazole
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