Chem
J-GLOBAL ID：200907051847774200   Nikkaji number：J1.141.109F

1,4-Bis[4-[4-[4-(acetylthio)phenylethynyl]phenylethynyl]phenylethynyl]benzene

1,4-ビス[4-[4-[4-(アセチルチオ)フェニルエチニル]フェニルエチニル]フェニルエチニル]ベンゼン
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： C58H34O2S2
Molecular formula furigana： C58-H34-O2-S2
Molecular weight： 827.030
InChI： InChI=1S/C58H34O2S2/c1-43(59)61-57-39-35-55(36-40-57)33-31-53-27-23-51(24-28-53)21-19-49-15-11-47(12-16-49)9-7-45-3-5-46(6-4-45)8-10-48-13-17-50(18-14-48)20-22-52-25-29-54(30-26-52)32-34-56-37-41-58(42-38-56)62-44(2)60/h3-6,11-18,23-30,35-42H,1-2H3
InChI key： WVJCZPUUHIZQRU-UHFFFAOYSA-N
SMILES： CC(=O)Sc1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccc(SC(=O)C)cc1
Systematic name  (5)：
  • 1,4-ビス[[4-[[4-[[4-(アセチルチオ)フェニル]エチニル]フェニル]エチニル]フェニル]エチニル]ベンゼン
  • 1,4-ビス[4-[4-[4-(アセチルチオ)フェニルエチニル]フェニルエチニル]フェニルエチニル]ベンゼン
  • チオ酢酸S-[4-[4-[4-[4-[4-[4-[4-(アセチルチオ)フェニルエチニル]フェニルエチニル]フェニルエチニル]フェニルエチニル]フェニルエチニル]フェニルエチニル]フェニル]
  • 1-{[4-(2-{4-[2-(4-{2-[4-(2-{4-[2-(4-{2-[4-(アセチルスルファニル)フェニル]エチニル}フェニル)エチニル]フェニル}エチニル)フェニル]エチニル}フェニル)エチニル]フェニル}エチニル)フェニル]スルファニル}エタン-1-オン
  • 1-{[4-(2-{4-[2-(4-{2-[4-(2-{4-[2-(4-{2-[4-(acetylsulfanyl)phenyl]ethynyl}phenyl)ethynyl]phenyl}ethynyl)phenyl]ethynyl}phenyl)ethynyl]phenyl}ethynyl)phenyl]sulfanyl}ethan-1-one
Other name (3)：
  • 1,4-Bis[[4-[[4-[[4-(acetylthio)phenyl]ethynyl]phenyl]ethynyl]phenyl]ethynyl]benzene
  • 1,4-Bis[4-[4-[4-(acetylthio)phenylethynyl]phenylethynyl]phenylethynyl]benzene
  • Thioacetic acid S-[4-[4-[4-[4-[4-[4-[4-(acetylthio)phenylethynyl]phenylethynyl]phenylethynyl]phenylethynyl]phenylethynyl]phenylethynyl]phenyl] ester
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