Chem
J-GLOBAL ID：200907066522660478
Nikkaji number：J1.792.878C
3-(Benzylthio)-4-butyl-4H-1,2,4-triazole
3-(ベンジルチオ)-4-ブチル-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： C13H17N3S
Molecular formula furigana： C13-H17-N3-S
Molecular weight： 247.360
InChI：
InChI=1S/C13H17N3S/c1-2-3-9-16-11-14-15-13(16)17-10-12-7-5-4-6-8-12/h4-8,11H,2-3,9-10H2,1H3
InChI key：
OLDOLOSITFBHOW-UHFFFAOYSA-N
SMILES：
CCCCn1cnnc1SCc1ccccc1
Systematic name (3)：
- 3-(ベンジルチオ)-4-ブチル-4H-1,2,4-トリアゾール
- 3-(ベンジルスルファニル)-4-ブチル-4H-1,2,4-トリアゾール
- 3-(benzylsulfanyl)-4-butyl-4H-1,2,4-triazole
- 3-(Benzylthio)-4-butyl-4H-1,2,4-triazole
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