Chem
J-GLOBAL ID:200907069594353579   Nikkaji number:J1.792.939I

3-[4-(Trifluoromethyl)benzylthio]-4-(4-methylphenyl)-4H-1,2,4-triazole

3-[4-(トリフルオロメチル)ベンジルチオ]-4-(4-メチルフェニル)-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: C17H14F3N3S
Molecular formula furigana: C17-H14-F3-N3-S
Molecular weight: 349.380
InChI: InChI=1S/C17H14F3N3S/c1-12-2-8-15(9-3-12)23-11-21-22-16(23)24-10-13-4-6-14(7-5-13)17(18,19)20/h2-9,11H,10H2,1H3
InChI key: PUIUGVPLIQDNAN-UHFFFAOYSA-N
SMILES: Cc1ccc(cc1)n1cnnc1SCc1ccc(cc1)C(F)(F)F
Systematic name  (3):
  • 3-[4-(トリフルオロメチル)ベンジルチオ]-4-(4-メチルフェニル)-4H-1,2,4-トリアゾール
  • 4-(4-メチルフェニル)-3-({[4-(トリフルオロメチル)フェニル]メチル}スルファニル)-4H-1,2,4-トリアゾール
  • 4-(4-methylphenyl)-3-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Other name (1):
  • 3-[4-(Trifluoromethyl)benzylthio]-4-(4-methylphenyl)-4H-1,2,4-triazole
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