Chem
J-GLOBAL ID:200907060158928011   Nikkaji number:J1.792.879A

3-(Benzylthio)-4-tert-butyl-4H-1,2,4-triazole

3-(ベンジルチオ)-4-tert-ブチル-4H-1,2,4-トリアゾール
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: C13H17N3S
Molecular formula furigana: C13-H17-N3-S
Molecular weight: 247.360
InChI: InChI=1S/C13H17N3S/c1-13(2,3)16-10-14-15-12(16)17-9-11-7-5-4-6-8-11/h4-8,10H,9H2,1-3H3
InChI key: LBYSGCQFNMWYGI-UHFFFAOYSA-N
SMILES: CC(C)(C)n1cnnc1SCc1ccccc1
Systematic name  (3):
  • 3-(ベンジルチオ)-4-tert-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-tert-ブチル-4H-1,2,4-トリアゾール
  • 3-(benzylsulfanyl)-4-tert-butyl-4H-1,2,4-triazole
Other name (1):
  • 3-(Benzylthio)-4-tert-butyl-4H-1,2,4-triazole
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