Chem
J-GLOBAL ID：200907068728368350
Nikkaji number：J1.792.882A
3-(Benzylthio)-4-benzyl-4H-1,2,4-triazole
3-(ベンジルチオ)-4-ベンジル-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： C16H15N3S
Molecular formula furigana： C16-H15-N3-S
Molecular weight： 281.380
InChI：
InChI=1S/C16H15N3S/c1-3-7-14(8-4-1)11-19-13-17-18-16(19)20-12-15-9-5-2-6-10-15/h1-10,13H,11-12H2
InChI key：
WAYFDCYVOJJEEG-UHFFFAOYSA-N
SMILES：
C(Sc1nncn1Cc1ccccc1)c1ccccc1
Systematic name (3)：
- 3-(ベンジルチオ)-4-ベンジル-4H-1,2,4-トリアゾール
- 4-ベンジル-3-(ベンジルスルファニル)-4H-1,2,4-トリアゾール
- 4-benzyl-3-(benzylsulfanyl)-4H-1,2,4-triazole
- 3-(Benzylthio)-4-benzyl-4H-1,2,4-triazole
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