Chem
J-GLOBAL ID:200907016918943351   Nikkaji number:J249.219I

3,3′-[2-[(1-Chloroethyl)oxy]-1,4-phenylenebis[iminocarbonyl(acetylmethylene)azo]]bis[N-[4-(1-chloroethyl)phenyl]-5-chlorobenzamide]

3,3′-[2-[(1-クロロエチル)オキシ]-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-[4-(1-クロロエチル)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: C46H41Cl5N8O7
Molecular formula furigana: C46-H41-CL5-N8-O7
Molecular weight: 995.130
InChI: InChI=1S/C46H41Cl5N8O7/c1-23(47)28-6-10-34(11-7-28)52-43(62)30-16-32(50)20-37(18-30)56-58-41(25(3)60)45(64)54-36-14-15-39(40(22-36)66-27(5)49)55-46(65)42(26(4)61)59-57-38-19-31(17-33(51)21-38)44(63)53-35-12-8-29(9-13-35)24(2)48/h6-24,27,41-42H,1-5H3,(H,52,62)(H,53,63)(H,54,64)(H,55,65)
InChI key: YQWCLBVHNWMNIH-UHFFFAOYSA-N
SMILES: CC(Cl)Oc1cc(NC(=O)C(N=Nc2cc(Cl)cc(c2)C(=O)Nc2ccc(cc2)C(C)Cl)C(=O)C)ccc1NC(=O)C(N=Nc1cc(Cl)cc(c1)C(=O)Nc1ccc(cc1)C(C)Cl)C(=O)C
Systematic name  (3):
  • 3,3′-[2-[(1-クロロエチル)オキシ]-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-[4-(1-クロロエチル)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-{[4-(1-クロロエチル)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}-3-(1-クロロエトキシ)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-[4-(1-クロロエチル)フェニル]ベンズアミド
  • 3-chloro-5-(2-{1-[(4-{2-[2-(3-chloro-5-{[4-(1-chloroethyl)phenyl]carbamoyl}phenyl)diazen-1-yl]-3-oxobutanamido}-3-(1-chloroethoxy)phenyl)carbamoyl]-2-oxopropyl}diazen-1-yl)-N-[4-(1-chloroethyl)phenyl]benzamide
Other name (1):
  • 3,3′-[2-[(1-Chloroethyl)oxy]-1,4-phenylenebis[iminocarbonyl(acetylmethylene)azo]]bis[N-[4-(1-chloroethyl)phenyl]-5-chlorobenzamide]
Regulation number (1):
  • (3)-3021
Thsaurus map:

Return to Previous Page