Chem
J-GLOBAL ID:200907049252064434   Nikkaji number:J248.650D

3,3′-[2,5-Diethyl-1,4-phenylenebis[iminocarbonyl(acetylmethylene)azo]]bis[N-(2,4,6-trichlorophenyl)-5-chlorobenzamide]

3,3′-[2,5-ジエチル-1,4-フェニレンビス[イミノカルボニル(アセチルメチレン)アゾ]]ビス[N-(2,4,6-トリクロロフェニル)-5-クロロベンズアミド]
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: C44H34Cl8N8O6
Molecular formula furigana: C44-H34-CL8-N8-O6
Molecular weight: 1054.410
InChI: InChI=1S/C44H34Cl8N8O6/c1-5-21-11-36(54-44(66)38(20(4)62)60-58-30-10-24(8-26(46)14-30)42(64)56-40-33(51)17-28(48)18-34(40)52)22(6-2)12-35(21)53-43(65)37(19(3)61)59-57-29-9-23(7-25(45)13-29)41(63)55-39-31(49)15-27(47)16-32(39)50/h7-18,37-38H,5-6H2,1-4H3,(H,53,65)(H,54,66)(H,55,63)(H,56,64)
InChI key: ZYBRWYGWDZQMII-UHFFFAOYSA-N
SMILES: CCc1cc(NC(=O)C(N=Nc2cc(Cl)cc(c2)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)C(=O)C)c(CC)cc1NC(=O)C(N=Nc1cc(Cl)cc(c1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl)C(=O)C
Systematic name  (3):
  • 3,3′-[2,5-ジエチル-1,4-フェニレンビス[イミノカルボニル(アセチルメチレン)アゾ]]ビス[N-(2,4,6-トリクロロフェニル)-5-クロロベンズアミド]
  • 3-クロロ-5-{2-[1-({4-[2-(2-{3-クロロ-5-[(2,4,6-トリクロロフェニル)カルバモイル]フェニル}ジアゼン-1-イル)-3-オキソブタンアミド]-2,5-ジエチルフェニル}カルバモイル)-2-オキソプロピル]ジアゼン-1-イル}-N-(2,4,6-トリクロロフェニル)ベンズアミド
  • 3-chloro-5-{2-[1-({4-[2-(2-{3-chloro-5-[(2,4,6-trichlorophenyl)carbamoyl]phenyl}diazen-1-yl)-3-oxobutanamido]-2,5-diethylphenyl}carbamoyl)-2-oxopropyl]diazen-1-yl}-N-(2,4,6-trichlorophenyl)benzamide
Other name (1):
  • 3,3′-[2,5-Diethyl-1,4-phenylenebis[iminocarbonyl(acetylmethylene)azo]]bis[N-(2,4,6-trichlorophenyl)-5-chlorobenzamide]
Regulation number (1):
  • (3)-3014
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