Chem
J-GLOBAL ID：200907061563294700   Nikkaji number：J2.021.791J

Ki-16425

Ki-16425
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： C23H23ClN2O7S
Molecular formula furigana： C23-H23-CL-N2-O7-S
Molecular weight： 506.950
InChI： InChI=1S/C23H23ClN2O7S/c1-14-21(25-23(29)32-15(2)18-5-3-4-6-19(18)24)22(33-26-14)17-9-7-16(8-10-17)13-34(30,31)12-11-20(27)28/h3-10,15H,11-13H2,1-2H3,(H,25,29)(H,27,28)
InChI key： PZNTWXZLOWZVDM-UHFFFAOYSA-N
SMILES： CC(OC(=O)Nc1c(C)noc1c1ccc(CS(=O)(=O)CCC(=O)O)cc1)c1ccccc1Cl
Systematic name  (4)：
  • 3-[[4-[3-メチル-4-[[[1-(2-クロロフェニル)エトキシ]カルボニル]アミノ]イソオキサゾール-5-イル]ベンジル]スルホニル]プロパン酸
  • 3-[[4-[4-[[[1-(2-クロロフェニル)エトキシ]カルボニル]アミノ]-3-メチルイソオキサゾール-5-イル]ベンジル]スルホニル]プロパン酸
  • 3-({4-[4-({[1-(2-クロロフェニル)エトキシ]カルボニル}アミノ)-3-メチル-1,2-オキサゾール-5-イル]フェニル}メタンスルホニル)プロパン酸
  • 3-({4-[4-({[1-(2-chlorophenyl)ethoxy]carbonyl}amino)-3-methyl-1,2-oxazol-5-yl]phenyl}methanesulfonyl)propanoic acid
Other name (4)：
  • 3-[[4-[3-Methyl-4-[[[1-(2-chlorophenyl)ethoxy]carbonyl]amino]isoxazole-5-yl]benzyl]sulfonyl]propanoic acid
  • Ki-6425
  • 3-[[4-[4-[[[1-(2-Chlorophenyl)ethoxy]carbonyl]amino]-3-methylisoxazole-5-yl]benzyl]sulfonyl]propanoic acid
  • Ki-16425
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