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CAS 1262681-31-1

:

(3aS,4S,6aR)-Hexahydro-2-oxo-N-3,6,9,12-tetraoxapentadec-14-yn-1-yl-1H-thieno[3,4-d]imidazole-4-pentanamide

Description:
The chemical substance known as (3aS,4S,6aR)-Hexahydro-2-oxo-N-3,6,9,12-tetraoxapentadec-14-yn-1-yl-1H-thieno[3,4-d]imidazole-4-pentanamide, with the CAS number 1262681-31-1, is a complex organic compound characterized by its unique structural features. It contains multiple functional groups, including a thieno[3,4-d]imidazole moiety, which contributes to its potential biological activity. The presence of a hexahydro structure indicates a saturated cyclic component, while the oxo and amide functionalities suggest reactivity and potential interactions with biological targets. The tetraoxapentadec chain implies a long carbon backbone with several ether-like linkages, which may influence solubility and stability. The stereochemistry, denoted by the specific configuration at various chiral centers, is crucial for its biological activity and interaction with enzymes or receptors. Overall, this compound's intricate structure suggests it may have applications in medicinal chemistry, particularly in the development of pharmaceuticals targeting specific biological pathways. Further studies would be necessary to elucidate its properties and potential uses.
Formula:C21H35N3O6S
InChI:InChI=1S/C21H35N3O6S/c1-2-8-27-10-12-29-14-15-30-13-11-28-9-7-22-19(25)6-4-3-5-18-20-17(16-31-18)23-21(26)24-20/h1,17-18,20H,3-16H2,(H,22,25)(H2,23,24,26)/t17-,18-,20-/m0/s1
InChI key:InChIKey=SKMJWNZZFUDLKQ-BJLQDIEVSA-N
SMILES:C(CCCC(NCCOCCOCCOCCOCC#C)=O)[C@H]1[C@@]2([C@](CS1)(NC(=O)N2)[H])[H]
Synonyms:
  • 1H-Thieno[3,4-d]imidazole-4-pentanamide, hexahydro-2-oxo-N-3,6,9,12-tetraoxapentadec-14-yn-1-yl-, (3aS,4S,6aR)-
  • (3aS,4S,6aR)-Hexahydro-2-oxo-N-3,6,9,12-tetraoxapentadec-14-yn-1-yl-1H-thieno[3,4-d]imidazole-4-pentanamide
  • Biotin-PEG4-Alkyne
  • 5-((3aS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)-N-(3,6,9,12-tetraoxapentadec-14-yn-1-yl)pentanamide
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