Chem
J-GLOBAL ID：200907041925617219   Nikkaji number：J929.024I

1-Methyl-2,5-dioxo-4-(methylthio)-3-pyrroline-3-carboxylic acid methyl ester

1-メチル-2,5-ジオキソ-4-(メチルチオ)-3-ピロリン-3-カルボン酸メチル
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： C8H9NO4S
Molecular formula furigana： C8-H9-N-O4-S
Molecular weight： 215.220
InChI： InChI=1S/C8H9NO4S/c1-9-6(10)4(8(12)13-2)5(14-3)7(9)11/h1-3H3
InChI key： AKSLZIZGGDXYIO-UHFFFAOYSA-N
SMILES： COC(=O)C1=C(SC)C(=O)N(C)C1=O
Systematic name  (4)：
  • 1-メチル-4-(メチルチオ)-2,5-ジオキソ-2,5-ジヒドロ-1H-ピロール-3-カルボン酸メチル
  • 1-メチル-2,5-ジオキソ-4-(メチルチオ)-3-ピロリン-3-カルボン酸メチル
  • メチル 1-メチル-4-(メチルスルファニル)-2,5-ジオキソ-2,5-ジヒドロ-1H-ピロール-3-カルボキシラート
  • methyl 1-methyl-4-(methylsulfanyl)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carboxylate
Other name (2)：
  • 1-Methyl-4-(methylthio)-2,5-dioxo-2,5-dihydro-1H-pyrrole-3-carboxylic acid methyl ester
  • 1-Methyl-2,5-dioxo-4-(methylthio)-3-pyrroline-3-carboxylic acid methyl ester
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