Chem
J-GLOBAL ID：200907060951015442
Nikkaji number：J1.792.870H
3-(α-Methylbenzylthio)-4-phenyl-4H-1,2,4-triazole
3-(α-メチルベンジルチオ)-4-フェニル-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/c1-13(14-8-4-2-5-9-14)20-16-18-17-12-19(16)15-10-6-3-7-11-15/h2-13H,1H3
InChI key：
UGBSUYYSMFCTSB-UHFFFAOYSA-N
SMILES：
CC(Sc1nncn1c1ccccc1)c1ccccc1
Systematic name (3)：
- 3-(α-メチルベンジルチオ)-4-フェニル-4H-1,2,4-トリアゾール
- 4-フェニル-3-[(1-フェニルエチル)スルファニル]-4H-1,2,4-トリアゾール
- 4-phenyl-3-[(1-phenylethyl)sulfanyl]-4H-1,2,4-triazole
- 3-(α-Methylbenzylthio)-4-phenyl-4H-1,2,4-triazole
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