Chem
J-GLOBAL ID：200907027177146442   Nikkaji number：J943.006G

2-Ketomolinate

2-ケトモリナート
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： C9H15NO2S
Molecular formula furigana： C9-H15-N-O2-S
Molecular weight： 201.280
InChI： InChI=1S/C9H15NO2S/c1-2-13-9(12)10-7-5-3-4-6-8(10)11/h2-7H2,1H3
InChI key： UUJZYIUAPPVYMH-UHFFFAOYSA-N
SMILES： CCSC(=O)N1CCCCCC1=O
Systematic name  (5)：
  • ヘキサヒドロ-2-オキソ-1H-アゼピン-1-カルボチオ酸S-エチル
  • 2-オキソヘキサヒドロ-1H-アゼピン-1-チオカルボン酸S-エチル
  • 2-オキソヘキサヒドロ-1H-アゼピン-1-カルボチオ酸S-エチル
  • 1-[(エチルスルファニル)カルボニル]アゼパン-2-オン
  • 1-[(ethylsulfanyl)carbonyl]azepan-2-one
Other name (5)：
  • 2-ケトモリナート
  • 2-Ketomolinate
  • Hexahydro-2-oxo-1H-azepine-1-carbothioic acid S-ethyl ester
  • 2-Oxohexahydro-1H-azepine-1-thiocarboxylic acid S-ethyl ester
  • 2-Oxohexahydro-1H-azepine-1-carbothioic acid S-ethyl ester
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