Chem
J-GLOBAL ID：200907064570853064   Nikkaji number：J1.236.419I

1-Cyano-7-methyl-2-[[1,2-bis(methoxycarbonyl)ethenyl]thio]indolizine-3-carboxylic acid ethyl ester

1-シアノ-7-メチル-2-[[1,2-ビス(メトキシカルボニル)エテニル]チオ]インドリジン-3-カルボン酸エチル
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： C19H18N2O6S
Molecular formula furigana： C19-H18-N2-O6-S
Molecular weight： 402.420
InChI： InChI=1S/C19H18N2O6S/c1-5-27-19(24)16-17(28-14(18(23)26-4)9-15(22)25-3)12(10-20)13-8-11(2)6-7-21(13)16/h6-9H,5H2,1-4H3
InChI key： QZNVKFUXDWMAJD-UHFFFAOYSA-N
SMILES： CCOC(=O)c1c(SC(=CC(=O)OC)C(=O)OC)c(C#N)c2cc(C)ccn12
Systematic name  (3)：
  • 1-シアノ-7-メチル-2-[[1,2-ビス(メトキシカルボニル)エテニル]チオ]インドリジン-3-カルボン酸エチル
  • 1,4-ジメチル 2-{[1-シアノ-3-(エトキシカルボニル)-7-メチルインドリジン-2-イル]スルファニル}ブタ-2-エンジオアート
  • 1,4-dimethyl 2-{[1-cyano-3-(ethoxycarbonyl)-7-methylindolizin-2-yl]sulfanyl}but-2-enedioate
Other name (1)：
  • 1-Cyano-7-methyl-2-[[1,2-bis(methoxycarbonyl)ethenyl]thio]indolizine-3-carboxylic acid ethyl ester
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