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CAS 811442-85-0

:

(3aS,4S,6aR)-N-[2-(2-Aminoethoxy)ethyl]hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanamide

Description:
The chemical substance with the name "(3aS,4S,6aR)-N-[2-(2-Aminoethoxy)ethyl]hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanamide" and CAS number "811442-85-0" is a complex organic compound characterized by its thieno[3,4-d]imidazole core structure, which incorporates a hexahydro-2-oxo moiety. This compound features multiple stereocenters, indicated by its specific stereochemical descriptors (3aS, 4S, 6aR), suggesting that it exhibits chirality and may exist in multiple enantiomeric forms. The presence of an aminoethoxy group contributes to its potential biological activity, possibly influencing its interaction with biological targets. The pentanamide functional group indicates that it may participate in hydrogen bonding and other interactions, enhancing its solubility and reactivity. Overall, this compound's unique structural features suggest potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, although specific biological activities and properties would require further investigation through experimental studies.
Formula:C14H26N4O3S
InChI:InChI=1S/C14H26N4O3S/c15-5-7-21-8-6-16-12(19)4-2-1-3-11-13-10(9-22-11)17-14(20)18-13/h10-11,13H,1-9,15H2,(H,16,19)(H2,17,18,20)/t10-,11-,13-/m0/s1
InChI key:InChIKey=MJCKXPHJERSYIX-GVXVVHGQSA-N
SMILES:C(CCCC(NCCOCCN)=O)[C@H]1[C@@]2([C@](CS1)(NC(=O)N2)[H])[H]
Synonyms:
  • (3aS,4S,6aR)-N-[2-(2-Aminoethoxy)ethyl]hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanamide
  • 1H-Thieno[3,4-d]imidazole-4-pentanamide, N-[2-(2-aminoethoxy)ethyl]hexahydro-2-oxo-, (3aS,4S,6aR)-
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