Chem
J-GLOBAL ID：201407074151204710   Nikkaji number：J3.240.559B

1-[2-(2,4-Dimethylphenyl)-4,5-bis(propylsulfonyl)-3-furyl]-3,5-dimethylpyridinium

1-[2-(2,4-ジメチルフェニル)-4,5-ビス(プロピルスルホニル)-3-フリル]-3,5-ジメチルピリジニウム
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： C25H32[N+]O5S2
Molecular formula furigana： C25-H32-N-O5-S2
Molecular weight： 490.650
InChI： InChI=1S/C25H32NO5S2/c1-7-11-32(27,28)24-22(26-15-18(4)13-19(5)16-26)23(21-10-9-17(3)14-20(21)6)31-25(24)33(29,30)12-8-2/h9-10,13-16H,7-8,11-12H2,1-6H3/q+1
InChI key： POOCBUGAKLBJHL-UHFFFAOYSA-N
SMILES： CCCS(=O)(=O)c1oc(c(c1S(=O)(=O)CCC)[n+]1cc(C)cc(C)c1)c1ccc(C)cc1C
Systematic name  (3)：
  • 1-[2-(2,4-ジメチルフェニル)-4,5-ビス(プロピルスルホニル)-3-フリル]-3,5-ジメチルピリジニウム
  • 1-[2-(2,4-ジメチルフェニル)-4,5-ビス(プロパン-1-スルホニル)フラン-3-イル]-3,5-ジメチル-1λ5-ピリジン-1-イリウム
  • 1-[2-(2,4-dimethylphenyl)-4,5-bis(propane-1-sulfonyl)furan-3-yl]-3,5-dimethyl-1λ5-pyridin-1-ylium
Other name (1)：
  • 1-[2-(2,4-Dimethylphenyl)-4,5-bis(propylsulfonyl)-3-furyl]-3,5-dimethylpyridinium
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