Chem
J-GLOBAL ID：200907006609756177   Nikkaji number：J1.390.462F

4,4′-Bis(diethylamino)-6-(butylamino)-6′-[3-(guanidinomethyl)benzylamino]-[2,2′-[m-phenylenebis(methyleneimino)]bis(s-triazine)]

4,4′-ビス(ジエチルアミノ)-6-(ブチルアミノ)-6′-[3-(グアニジノメチル)ベンジルアミノ]-[2,2′-[m-フェニレンビス(メチレンイミノ)]ビス(s-トリアジン)]
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： C35H53N15
Molecular formula furigana： C35-H53-N15
Molecular weight： 683.914
InChI： InChI=1S/C35H53N15/c1-6-11-18-38-30-43-31(46-34(45-30)49(7-2)8-3)40-23-27-16-13-17-28(20-27)24-42-33-44-32(47-35(48-33)50(9-4)10-5)41-22-26-15-12-14-25(19-26)21-39-29(36)37/h12-17,19-20H,6-11,18,21-24H2,1-5H3,(H4,36,37,39)(H2,38,40,43,45,46)(H2,41,42,44,47,48)
InChI key： HJZAKWCZHCPIJY-UHFFFAOYSA-N
SMILES： CCCCNc1nc(NCc2cccc(CNc3nc(NCc4cccc(CNC(=N)N)c4)nc(n3)N(CC)CC)c2)nc(n1)N(CC)CC
Systematic name  (3)：
  • 4,4′-ビス(ジエチルアミノ)-6-(ブチルアミノ)-6′-[3-(グアニジノメチル)ベンジルアミノ]-[2,2′-[m-フェニレンビス(メチレンイミノ)]ビス(s-トリアジン)]
  • N-{[3-({[4-({[3-({[4-(ブチルアミノ)-6-(ジエチルアミノ)-1,3,5-トリアジン-2-イル]アミノ}メチル)フェニル]メチル}アミノ)-6-(ジエチルアミノ)-1,3,5-トリアジン-2-イル]アミノ}メチル)フェニル]メチル}グアニジン
  • N-{[3-({[4-({[3-({[4-(butylamino)-6-(diethylamino)-1,3,5-triazin-2-yl]amino}methyl)phenyl]methyl}amino)-6-(diethylamino)-1,3,5-triazin-2-yl]amino}methyl)phenyl]methyl}guanidine
Other name (1)：
  • 4,4′-Bis(diethylamino)-6-(butylamino)-6′-[3-(guanidinomethyl)benzylamino]-[2,2′-[m-phenylenebis(methyleneimino)]bis(s-triazine)]
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