Chem
J-GLOBAL ID：200907065521707750   Nikkaji number：J360.538H

5-[4-(5-Isoquinolinylsulfonyl)-1-piperazinyl]valeric acid methyl ester

5-[4-(5-イソキノリニルスルホニル)-1-ピペラジニル]吉草酸メチル
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： C19H25N3O4S
Molecular formula furigana： C19-H25-N3-O4-S
Molecular weight： 391.490
InChI： InChI=1S/C19H25N3O4S/c1-26-19(23)7-2-3-10-21-11-13-22(14-12-21)27(24,25)18-6-4-5-16-15-20-9-8-17(16)18/h4-6,8-9,15H,2-3,7,10-14H2,1H3
InChI key： KQTIDAKABWWMJE-UHFFFAOYSA-N
SMILES： COC(=O)CCCCN1CCN(CC1)S(=O)(=O)c1cccc2cnccc12
Systematic name  (3)：
  • 5-[4-(5-イソキノリニルスルホニル)-1-ピペラジニル]吉草酸メチル
  • メチル 5-[4-(イソキノリン-5-スルホニル)ピペラジン-1-イル]ペンタノアート
  • methyl 5-[4-(isoquinoline-5-sulfonyl)piperazin-1-yl]pentanoate
Other name (1)：
  • 5-[4-(5-Isoquinolinylsulfonyl)-1-piperazinyl]valeric acid methyl ester
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