Chem
J-GLOBAL ID：200907025102419262   Nikkaji number：J568.022K

KN-93

KN-93
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： C26H29ClN2O4S
Molecular formula furigana： C26-H29-CL-N2-O4-S
Molecular weight： 501.040
InChI： InChI=1S/C26H29ClN2O4S/c1-28(17-5-6-21-9-11-23(27)12-10-21)20-22-7-3-4-8-26(22)29(18-19-30)34(31,32)25-15-13-24(33-2)14-16-25/h3-16,30H,17-20H2,1-2H3/b6-5+
InChI key： LLLQTDSSHZREGW-AATRIKPKSA-N
SMILES： COc1ccc(cc1)S(=O)(=O)N(CCO)c1ccccc1CN(C)C/C=C/c1ccc(Cl)cc1
Systematic name  (4)：
  • N-(2-ヒドロキシエチル)-N-[2-[[N-[(E)-3-(4-クロロフェニル)-2-プロペニル]-N-メチルアミノ]メチル]フェニル]-4-メトキシベンゼンスルホンアミド
  • 2-[2-ヒドロキシエチル(4-メトキシフェニルスルホニル)アミノ]-N-(4-クロロシンナミル)-N-メチルベンゼンメタンアミン
  • N-[2-({[(2E)-3-(4-クロロフェニル)プロパ-2-エン-1-イル](メチル)アミノ}メチル)フェニル]-N-(2-ヒドロキシエチル)-4-メトキシベンゼン-1-スルホンアミド
  • N-[2-({[(2E)-3-(4-chlorophenyl)prop-2-en-1-yl](methyl)amino}methyl)phenyl]-N-(2-hydroxyethyl)-4-methoxybenzene-1-sulfonamide
Other name (3)：
  • KN-93
  • N-(2-Hydroxyethyl)-N-[2-[[N-[(E)-3-(4-chlorophenyl)-2-propenyl]-N-methylamino]methyl]phenyl]-4-methoxybenzenesulfonamide
  • 2-[2-Hydroxyethyl(4-methoxyphenylsulfonyl)amino]-N-(4-chlorocinnamyl)-N-methylbenzenemethanamine
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