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CAS 177615-44-0

:

1,1-Dimethylethyl (2S,4S)-2-[(dimethylamino)carbonyl]-4-mercapto-1-pyrrolidinecarboxylate

Description:
1,1-Dimethylethyl (2S,4S)-2-[(dimethylamino)carbonyl]-4-mercapto-1-pyrrolidinecarboxylate, with the CAS number 177615-44-0, is a chemical compound characterized by its complex structure, which includes a pyrrolidine ring, a dimethylamino group, and a mercapto group. This compound is typically classified as a derivative of pyrrolidine, a five-membered nitrogen-containing heterocycle. The presence of the dimethylamino group suggests potential applications in medicinal chemistry, particularly in drug design, due to its ability to interact with biological targets. The mercapto group indicates that the compound may exhibit thiol-related reactivity, which can be significant in biochemical processes. Additionally, the stereochemistry indicated by the (2S,4S) configuration suggests specific spatial arrangements that can influence the compound's biological activity and interactions. Overall, this compound's unique functional groups and stereochemistry contribute to its potential utility in various chemical and pharmaceutical applications.
Formula:C12H22N2O3S
InChI:InChI=1S/C12H22N2O3S/c1-12(2,3)17-11(16)14-7-8(18)6-9(14)10(15)13(4)5/h8-9,18H,6-7H2,1-5H3/t8-,9-/m0/s1
InChI key:InChIKey=HQNIEAGZNKTTIT-IUCAKERBSA-N
SMILES:C(OC(C)(C)C)(=O)N1[C@H](C(N(C)C)=O)C[C@H](S)C1
Synonyms:
  • 1-Pyrrolidinecarboxylic acid, 2-[(dimethylamino)carbonyl]-4-mercapto-, 1,1-dimethylethyl ester, (2S-cis)-
  • 1,1-Dimethylethyl (2S,4S)-2-[(dimethylamino)carbonyl]-4-mercapto-1-pyrrolidinecarboxylate
  • 1-Pyrrolidinecarboxylic acid, 2-[(dimethylamino)carbonyl]-4-mercapto-, 1,1-dimethylethyl ester, (2S,4S)-
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