Chem
J-GLOBAL ID：200907074305392700   Nikkaji number：J2.537.198D

2-[4-(Heptyloxy)phenyl]-6-(butylthio)benzothiazole

2-[4-(ヘプチルオキシ)フェニル]-6-(ブチルチオ)ベンゾチアゾール
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： C24H31NOS2
Molecular formula furigana： C24-H31-N-O-S2
Molecular weight： 413.640
InChI： InChI=1S/C24H31NOS2/c1-3-5-7-8-9-16-26-20-12-10-19(11-13-20)24-25-22-15-14-21(18-23(22)28-24)27-17-6-4-2/h10-15,18H,3-9,16-17H2,1-2H3
InChI key： HETCXOBLLFYBQL-UHFFFAOYSA-N
SMILES： CCCCCCCOc1ccc(cc1)c1nc2ccc(SCCCC)cc2s1
Systematic name  (3)：
  • 2-[4-(ヘプチルオキシ)フェニル]-6-(ブチルチオ)ベンゾチアゾール
  • 6-(ブチルスルファニル)-2-[4-(ヘプチルオキシ)フェニル]-1,3-ベンゾチアゾール
  • 6-(butylsulfanyl)-2-[4-(heptyloxy)phenyl]-1,3-benzothiazole
Other name (1)：
  • 2-[4-(Heptyloxy)phenyl]-6-(butylthio)benzothiazole
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