Chem
J-GLOBAL ID：200907073863605170   Nikkaji number：J378.757E

N-[1-[(4-(Methylthio)phenyl)amino]ethyl]-N-(4-nitrophenyl)-3-nitrobenzenesulfonamide

N-[1-[(4-(メチルチオ)フェニル)アミノ]エチル]-N-(4-ニトロフェニル)-3-ニトロベンゼンスルホンアミド
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： C21H20N2[N+]2O4[O-]2S2
Molecular formula furigana： C21-H20-N4-O6-S2
Molecular weight： 488.530
InChI： InChI=1S/C21H20N4O6S2/c1-15(22-16-6-12-20(32-2)13-7-16)23(17-8-10-18(11-9-17)24(26)27)33(30,31)21-5-3-4-19(14-21)25(28)29/h3-15,22H,1-2H3
InChI key： CDIBOUNAYPDFRN-UHFFFAOYSA-N
SMILES： CSc1ccc(NC(C)N(c2ccc(cc2)[N+](=O)[O-])S(=O)(=O)c2cccc(c2)[N+](=O)[O-])cc1
Systematic name  (3)：
  • N-[1-[(4-(メチルチオ)フェニル)アミノ]エチル]-N-(4-ニトロフェニル)-3-ニトロベンゼンスルホンアミド
  • N-(1-{[4-(メチルスルファニル)フェニル]アミノ}エチル)-3-ニトロ-N-(4-ニトロフェニル)ベンゼン-1-スルホンアミド
  • N-(1-{[4-(methylsulfanyl)phenyl]amino}ethyl)-3-nitro-N-(4-nitrophenyl)benzene-1-sulfonamide
Other name (1)：
  • N-[1-[(4-(Methylthio)phenyl)amino]ethyl]-N-(4-nitrophenyl)-3-nitrobenzenesulfonamide
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