Chem
J-GLOBAL ID：200907073587903242   Nikkaji number：J921.111J

3-Cyano-4-(methylthio)-6-(4-bromophenyl)-2H-pyran-2-one

3-シアノ-4-(メチルチオ)-6-(4-ブロモフェニル)-2H-ピラン-2-オン
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： C13H8BrNO2S
Molecular formula furigana： C13-H8-BR-N-O2-S
Molecular weight： 322.180
InChI： InChI=1S/C13H8BrNO2S/c1-18-12-6-11(17-13(16)10(12)7-15)8-2-4-9(14)5-3-8/h2-6H,1H3
InChI key： QLIZWGWIQMJGMB-UHFFFAOYSA-N
SMILES： CSc1cc(oc(=O)c1C#N)c1ccc(Br)cc1
Systematic name  (5)：
  • 2-オキソ-4-(メチルチオ)-6-(4-ブロモフェニル)-2H-ピラン-3-カルボニトリル
  • 6-(4-ブロモフェニル)-2-オキソ-4-(メチルチオ)-2H-ピラン-3-カルボニトリル
  • 3-シアノ-4-(メチルチオ)-6-(4-ブロモフェニル)-2H-ピラン-2-オン
  • 6-(4-ブロモフェニル)-4-(メチルスルファニル)-2-オキソ-2H-ピラン-3-カルボニトリル
  • 6-(4-bromophenyl)-4-(methylsulfanyl)-2-oxo-2H-pyran-3-carbonitrile
Other name (3)：
  • 2-Oxo-4-(methylthio)-6-(4-bromophenyl)-2H-pyran-3-carbonitrile
  • 6-(4-Bromophenyl)-2-oxo-4-(methylthio)-2H-pyran-3-carbonitrile
  • 3-Cyano-4-(methylthio)-6-(4-bromophenyl)-2H-pyran-2-one
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