Chem
J-GLOBAL ID：200907096416376392   Nikkaji number：J496.973A

N-[(2-Methylphenyl)sulfonyl]-3-methoxy-4-[[3-[2-(dimethylcarbamoyl)propyl]-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-(ジメチルカルバモイル)プロピル]-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： C37H44N4O6S
Molecular formula furigana： C37-H44-N4-O6-S
Molecular weight： 672.840
InChI： InChI=1S/C37H44N4O6S/c1-24-10-6-9-13-34(24)48(45,46)39-36(43)28-14-15-29(33(20-28)47-5)22-41-23-30(18-25(2)37(44)40(3)4)31-17-16-27(19-32(31)41)35(42)38-21-26-11-7-8-12-26/h6,9-10,13-17,19-20,23,25-26H,7-8,11-12,18,21-22H2,1-5H3,(H,38,42)(H,39,43)
InChI key： WKOYONPYWUNAHK-UHFFFAOYSA-N
SMILES： COc1cc(ccc1Cn1cc(CC(C)C(=O)N(C)C)c2ccc(cc12)C(=O)NCC1CCCC1)C(=O)NS(=O)(=O)c1ccccc1C
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-(ジメチルカルバモイル)プロピル]-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-(ジメチルカルバモイル)-2-メチルエチル]-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-(dimethylcarbamoyl)-2-methylethyl]-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-(dimethylcarbamoyl)propyl]-6-[(cyclopentylmethyl)aminocarbonyl]-1H-indol-1-yl]methyl]benzamide
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