Chem
J-GLOBAL ID：201507020411180815   Nikkaji number：J3.440.891B

1-[3-(Acetylthio)propyl]-3-benzyl-1H-benzoimidazole-3-ium

1-[3-(アセチルチオ)プロピル]-3-ベンジル-1H-ベンゾイミダゾール-3-イウム
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： C19H21N[N+]OS
Molecular formula furigana： C19-H21-N2-O-S
Molecular weight： 325.450
InChI： InChI=1S/C19H21N2OS/c1-16(22)23-13-7-12-20-15-21(14-17-8-3-2-4-9-17)19-11-6-5-10-18(19)20/h2-6,8-11,15H,7,12-14H2,1H3/q+1
InChI key： DIKJWPGFUZACQC-UHFFFAOYSA-N
SMILES： CC(=O)SCCCn1c[n+](Cc2ccccc2)c2ccccc12
Systematic name  (3)：
  • 1-[3-(アセチルチオ)プロピル]-3-ベンジル-1H-ベンゾイミダゾール-3-イウム
  • 1-[3-(アセチルスルファニル)プロピル]-3-ベンジル-1H-1,3-ベンゾジアゾール-3-イウム
  • 1-[3-(acetylsulfanyl)propyl]-3-benzyl-1H-1,3-benzodiazol-3-ium
Other name (1)：
  • 1-[3-(Acetylthio)propyl]-3-benzyl-1H-benzoimidazole-3-ium
Thsaurus map：
Thesaurus Map

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