Chem
J-GLOBAL ID：200907025263493187   Nikkaji number：J1.356.294F

2-[3-[2-[2-[Bis[2-oxo-2-(potassiooxy)ethyl]amino]-5-methylphenoxy]ethoxy]-4-[bis[2-oxo-2-(potassiooxy)ethyl]amino]phenyl]-5-(trifluoromethyl)benzothiazole

2-[3-[2-[2-[ビス[2-オキソ-2-(ポタシオオキシ)エチル]アミノ]-5-メチルフェノキシ]エトキシ]-4-[ビス[2-オキソ-2-(ポタシオオキシ)エチル]アミノ]フェニル]-5-(トリフルオロメチル)ベンゾチアゾール
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： C31H24F3K4N3O10S
Molecular formula furigana： C31-H24-F3-K4-N3-O10-S
Molecular weight： 843.990
InChI： InChI=1S/C31H28F3N3O10S.4K/c1-17-2-5-21(36(13-26(38)39)14-27(40)41)23(10-17)46-8-9-47-24-11-18(3-6-22(24)37(15-28(42)43)16-29(44)45)30-35-20-12-19(31(32,33)34)4-7-25(20)48-30;;;;/h2-7,10-12H,8-9,13-16H2,1H3,(H,38,39)(H,40,41)(H,42,43)(H,44,45);;;;/q;4*+1/p-4
InChI key： PRWAMAKUHRFAIH-UHFFFAOYSA-J
SMILES： Cc1ccc(N(CC(=O)O[K])CC(=O)O[K])c(OCCOc2cc(ccc2N(CC(=O)O[K])CC(=O)O[K])c2nc3cc(ccc3s2)C(F)(F)F)c1
Systematic name  (3)：
  • 2-[3-[2-[2-[ビス[2-オキソ-2-(ポタシオオキシ)エチル]アミノ]-5-メチルフェノキシ]エトキシ]-4-[ビス[2-オキソ-2-(ポタシオオキシ)エチル]アミノ]フェニル]-5-(トリフルオロメチル)ベンゾチアゾール
  • カリウム 2-({2-[2-(2-{ビス[2-オキソ-2-(ポタッシオオキシ)エチル]アミノ}-5-[5-(トリフルオロメチル)-1,3-ベンゾチアゾール-2-イル]フェノキシ)エトキシ]-4-メチルフェニル}[2-オキソ-2-(ポタッシオオキシ)エチル]アミノ)アセタート
  • potassium 2-({2-[2-(2-{bis[2-oxo-2-(potassiooxy)ethyl]amino}-5-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]phenoxy)ethoxy]-4-methylphenyl}[2-oxo-2-(potassiooxy)ethyl]amino)acetate
Other name (1)：
  • 2-[3-[2-[2-[Bis[2-oxo-2-(potassiooxy)ethyl]amino]-5-methylphenoxy]ethoxy]-4-[bis[2-oxo-2-(potassiooxy)ethyl]amino]phenyl]-5-(trifluoromethyl)benzothiazole
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