Chem
J-GLOBAL ID：200907095043371240   Nikkaji number：J707.942G

4-[2-(3-Methylpyrazin-2-yl)ethenyl]thiocinnamic acid S-ethyl ester

4-[2-(3-メチルピラジン-2-イル)エテニル]チオけい皮酸S-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： C18H18N2OS
Molecular formula furigana： C18-H18-N2-O-S
Molecular weight： 310.420
InChI： InChI=1S/C18H18N2OS/c1-3-22-18(21)11-9-16-6-4-15(5-7-16)8-10-17-14(2)19-12-13-20-17/h4-13H,3H2,1-2H3/b10-8?,11-9+
InChI key： IFSMGNIXOZQGOF-IZYRKSBPSA-N
SMILES： CCSC(=O)/C=C/c1ccc(C=Cc2nccnc2C)cc1
Systematic name  (3)：
  • 4-[2-(3-メチルピラジン-2-イル)エテニル]チオけい皮酸S-エチル
  • (2E)-1-(エチルスルファニル)-3-{4-[2-(3-メチルピラジン-2-イル)エテニル]フェニル}プロパ-2-エン-1-オン
  • (2E)-1-(ethylsulfanyl)-3-{4-[2-(3-methylpyrazin-2-yl)ethenyl]phenyl}prop-2-en-1-one
Other name (1)：
  • 4-[2-(3-Methylpyrazin-2-yl)ethenyl]thiocinnamic acid S-ethyl ester
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