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CAS 148017-44-1

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1,1-Dimethylethyl (2S,4S)-2-[[(aminosulfonyl)[(1,1-dimethylethoxy)carbonyl]amino]methyl]-4-mercapto-1-pyrrolidinecarboxylate

Description:
1,1-Dimethylethyl (2S,4S)-2-[[(aminosulfonyl)[(1,1-dimethylethoxy)carbonyl]amino]methyl]-4-mercapto-1-pyrrolidinecarboxylate, with CAS number 148017-44-1, is a complex organic compound characterized by its unique structural features. It contains a pyrrolidine ring, which is a five-membered cyclic amine, and incorporates both a mercapto group (-SH) and a sulfonamide moiety, indicating potential reactivity and biological activity. The presence of the dimethylethyl group suggests steric hindrance, which may influence its interaction with biological targets. The compound's functional groups, including the carboxylate and aminosulfonyl groups, contribute to its solubility and reactivity in various chemical environments. This compound may be of interest in medicinal chemistry due to its potential applications in drug development, particularly in the design of inhibitors or modulators of biological pathways. Its stereochemistry, indicated by the (2S,4S) configuration, is crucial for its biological activity, as stereoisomers can exhibit significantly different properties and effects in biological systems.
Formula:C15H29N3O6S2
InChI:InChI=1S/C15H29N3O6S2/c1-14(2,3)23-12(19)17-9-11(25)7-10(17)8-18(26(16,21)22)13(20)24-15(4,5)6/h10-11,25H,7-9H2,1-6H3,(H2,16,21,22)/t10-,11-/m0/s1
InChI key:InChIKey=JQXFEQZHDMPMJE-QWRGUYRKSA-N
SMILES:C(N(C(OC(C)(C)C)=O)S(N)(=O)=O)[C@H]1N(C(OC(C)(C)C)=O)C[C@@H](S)C1
Synonyms:
  • 1,1-Dimethylethyl (2S,4S)-2-[[(aminosulfonyl)[(1,1-dimethylethoxy)carbonyl]amino]methyl]-4-mercapto-1-pyrrolidinecarboxylate
  • 1-Pyrrolidinecarboxylic acid, 2-[[(aminosulfonyl)[(1,1-dimethylethoxy)carbonyl]amino]methyl]-4-mercapto-, 1,1-dimethylethyl ester, (2S-cis)-
  • 1-Pyrrolidinecarboxylic acid, 2-[[(aminosulfonyl)[(1,1-dimethylethoxy)carbonyl]amino]methyl]-4-mercapto-, 1,1-dimethylethyl ester, (2S,4S)-
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