Chem
J-GLOBAL ID:200907083883567857
Nikkaji number:J1.356.286E
2-[3-[2-[2-[Bis[2-oxo-2-(potassiooxy)ethyl]amino]-5-fluorophenoxy]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-フルオロフェノキシ]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
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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:
C30 H21 F4 K4 N3 O10 S
Molecular formula furigana:
C30-H21-F4-K4-N3-O10-S
Molecular weight:
847.960
InChI:
InChI=1S/C30H25F4N3O10S.4K/c31-18-3-5-21(37(14-27(42)43)15-28(44)45)23(11-18)47-8-7-46-22-9-16(1-4-20(22)36(12-25(38)39)13-26(40)41)29-35-19-10-17(30(32,33)34)2-6-24(19)48-29;;;;/h1-6,9-11H,7-8,12-15H2,(H,38,39)(H,40,41)(H,42,43)(H,44,45);;;;/q;4*+1/p-4
InChI key:
BRKCNTQTXYIHAU-UHFFFAOYSA-J
SMILES:
Fc1ccc(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-フルオロフェノキシ]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-フルオロフェニル}[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-fluorophenyl}[2-oxo-2-(potassiooxy)ethyl]amino)acetate
Other name (1):
2-[3-[2-[2-[Bis[2-oxo-2-(potassiooxy)ethyl]amino]-5-fluorophenoxy]ethoxy]-4-[bis[2-oxo-2-(potassiooxy)ethyl]amino]phenyl]-5-(trifluoromethyl)benzothiazole
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