Chem
J-GLOBAL ID：200907019650497794   Nikkaji number：J1.027.328E

(S)-3-Methyl-2-[[N-(1-naphthylsulfonyl)isoleucyl]amino]butanal

(S)-3-メチル-2-[[N-(1-ナフチルスルホニル)イソロイシル]アミノ]ブタナール
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： C21H28N2O4S
Molecular formula furigana： C21-H28-N2-O4-S
Molecular weight： 404.530
InChI： InChI=1S/C21H28N2O4S/c1-5-15(4)20(21(25)22-18(13-24)14(2)3)23-28(26,27)19-12-8-10-16-9-6-7-11-17(16)19/h6-15,18,20,23H,5H2,1-4H3,(H,22,25)/t15-,18+,20-/m0/s1
InChI key： OSWTUQCVSFYKDC-CVAIRZPRSA-N
SMILES： CC[C@H](C)[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)N[C@H](C=O)C(C)C
Systematic name  (3)：
  • (S)-3-メチル-2-[[N-(1-ナフチルスルホニル)イソロイシル]アミノ]ブタナール
  • (2S,3S)-3-メチル-N-[(2S)-3-メチル-1-オキソブタン-2-イル]-2-(ナフタレン-1-スルホンアミド)ペンタンアミド
  • (2S,3S)-3-methyl-N-[(2S)-3-methyl-1-oxobutan-2-yl]-2-(naphthalene-1-sulfonamido)pentanamide
Other name (1)：
  • (S)-3-Methyl-2-[[N-(1-naphthylsulfonyl)isoleucyl]amino]butanal
Thsaurus map：
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