Chem
J-GLOBAL ID：200907075951486400   Nikkaji number：J496.975H

N-[(2-Methylphenyl)sulfonyl]-3-methoxy-4-[[3-[2-(diethylcarbamoyl)ethenyl]-6-[(cyclopentylmethyl)aminocarbonyl]-1H-indol-1-yl]methyl]benzamide

N-[(2-メチルフェニル)スルホニル]-3-メトキシ-4-[[3-[2-(ジエチルカルバモイル)エテニル]-6-[(シクロペンチルメチル)アミノカルボニル]-1H-インドール-1-イル]メチル]ベンズアミド
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： C38H44N4O6S
Molecular formula furigana： C38-H44-N4-O6-S
Molecular weight： 684.850
InChI： InChI=1S/C38H44N4O6S/c1-5-41(6-2)36(43)20-18-30-24-42(33-21-28(17-19-32(30)33)37(44)39-23-27-12-8-9-13-27)25-31-16-15-29(22-34(31)48-4)38(45)40-49(46,47)35-14-10-7-11-26(35)3/h7,10-11,14-22,24,27H,5-6,8-9,12-13,23,25H2,1-4H3,(H,39,44)(H,40,45)
InChI key： LIKAFNVBKDBDDO-UHFFFAOYSA-N
SMILES： CCN(CC)C(=O)C=Cc1cn(Cc2ccc(cc2OC)C(=O)NS(=O)(=O)c2ccccc2C)c2cc(ccc12)C(=O)NCC1CCCC1
Systematic name  (3)：
  • N-[(2-メチルフェニル)スルホニル]-3-メトキシ-4-[[3-[2-(ジエチルカルバモイル)エテニル]-6-[(シクロペンチルメチル)アミノカルボニル]-1H-インドール-1-イル]メチル]ベンズアミド
  • N-(シクロペンチルメチル)-3-[2-(ジエチルカルバモイル)エタ-1-エン-1-イル]-1-({2-メトキシ-4-[(2-メチルベンゼンスルホニル)カルバモイル]フェニル}メチル)-1H-インドール-6-カルボキサミド
  • N-(cyclopentylmethyl)-3-[2-(diethylcarbamoyl)eth-1-en-1-yl]-1-({2-methoxy-4-[(2-methylbenzenesulfonyl)carbamoyl]phenyl}methyl)-1H-indole-6-carboxamide
Other name (1)：
  • N-[(2-Methylphenyl)sulfonyl]-3-methoxy-4-[[3-[2-(diethylcarbamoyl)ethenyl]-6-[(cyclopentylmethyl)aminocarbonyl]-1H-indol-1-yl]methyl]benzamide
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