Chem
J-GLOBAL ID：200907029160069307
Nikkaji number：J1.792.871F
3-(α-Ethylbenzylthio)-4-phenyl-4H-1,2,4-triazole
3-(α-エチルベンジルチオ)-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： C17H17N3S
Molecular formula furigana： C17-H17-N3-S
Molecular weight： 295.400
InChI：
InChI=1S/C17H17N3S/c1-2-16(14-9-5-3-6-10-14)21-17-19-18-13-20(17)15-11-7-4-8-12-15/h3-13,16H,2H2,1H3
InChI key：
JSKHPFDMOBRZCB-UHFFFAOYSA-N
SMILES：
CCC(Sc1nncn1c1ccccc1)c1ccccc1
Systematic name (3)：
- 3-(α-エチルベンジルチオ)-4-フェニル-4H-1,2,4-トリアゾール
- 4-フェニル-3-[(1-フェニルプロピル)スルファニル]-4H-1,2,4-トリアゾール
- 4-phenyl-3-[(1-phenylpropyl)sulfanyl]-4H-1,2,4-triazole
- 3-(α-Ethylbenzylthio)-4-phenyl-4H-1,2,4-triazole
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