Chem
J-GLOBAL ID：201407085318171608   Nikkaji number：J3.326.518B

1-[6-[1,3-Bis(tetrahydro-2H-pyran-2-ylthio)propane-2-yloxy]hexyl]-3-methyl-1H-imidazole-3-ium

1-(6-{[1,3-ビス(オキサン-2-イルスルファニル)プロパン-2-イル]オキシ}ヘキシル)-3-メチル-1H-イミダゾール-3-イウム
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： C23H41N[N+]O3S2
Molecular formula furigana： C23-H41-N2-O3-S2
Molecular weight： 457.710
InChI： InChI=1S/C23H41N2O3S2/c1-24-13-14-25(20-24)12-6-2-3-7-15-26-21(18-29-22-10-4-8-16-27-22)19-30-23-11-5-9-17-28-23/h13-14,20-23H,2-12,15-19H2,1H3/q+1
InChI key： FUXIXOWBGQVZHT-UHFFFAOYSA-N
SMILES： C[n+]1ccn(CCCCCCOC(CSC2CCCCO2)CSC2CCCCO2)c1
Systematic name  (3)：
  • 1-[6-[1,3-ビス(テトラヒドロ-2H-ピラン-2-イルチオ)プロパン-2-イルオキシ]ヘキシル]-3-メチル-1H-イミダゾール-3-イウム
  • 1-(6-{[1,3-ビス(オキサン-2-イルスルファニル)プロパン-2-イル]オキシ}ヘキシル)-3-メチル-1H-イミダゾール-3-イウム
  • 1-(6-{[1,3-bis(oxan-2-ylsulfanyl)propan-2-yl]oxy}hexyl)-3-methyl-1H-imidazol-3-ium
Other name (1)：
  • 1-[6-[1,3-Bis(tetrahydro-2H-pyran-2-ylthio)propane-2-yloxy]hexyl]-3-methyl-1H-imidazole-3-ium
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