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CAS 96034-64-9

:

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

Description:
The chemical substance known as (4-Nitrophenyl)methyl (2S,4S)-2-[(dimethylamino)carbonyl]-4-mercapto-1-pyrrolidinecarboxylate, with the CAS number 96034-64-9, is a complex organic compound characterized by its unique structural features. It contains a pyrrolidine ring, which is a five-membered nitrogen-containing heterocycle, and incorporates functional groups such as a nitrophenyl moiety, a dimethylamino carbonyl group, and a mercapto group. The presence of the nitro group suggests potential reactivity and the ability to participate in electrophilic aromatic substitution reactions. The mercapto group indicates that the compound may exhibit thiol-related properties, such as nucleophilicity and potential for forming disulfide bonds. Additionally, the stereochemistry indicated by the (2S,4S) configuration suggests specific spatial arrangements that could influence the compound's biological activity and interactions. Overall, this compound may have applications in medicinal chemistry or as a biochemical probe, although its specific uses would depend on further research into its properties and reactivity.
Formula:C15H19N3O5S
InChI:InChI=1S/C15H19N3O5S/c1-16(2)14(19)13-7-12(24)8-17(13)15(20)23-9-10-3-5-11(6-4-10)18(21)22/h3-6,12-13,24H,7-9H2,1-2H3/t12-,13-/m0/s1
InChI key:InChIKey=VGLBNJWGUYQZHD-STQMWFEESA-N
SMILES:C(OCC1=CC=C(N(=O)=O)C=C1)(=O)N2[C@H](C(N(C)C)=O)C[C@H](S)C2
Synonyms:
  • ( 2S-CIS)side chain
  • (2S,4R)-2-carboxylic-4-hydroxy-1-(p-nitrobenzyloxycarbonyl)-1-pyrrolidine
  • (2S,4S)-1-Pyrrolidinecarboxylic acid, 2-[(dimethylamino)carbonyl]-4-mercapto-, (4-nitrophenyl)methyl ester
  • (2S,4S)-2-( dimethylamino-carbonyl)-4-mercapto-1-(p-nitrobenzyloxycarbonyl)-1-pyrrolidine
  • (2S,4S)-2-(Dimethylaminocarbonyl)-4-Mercapto-1-(P-Nitrobenzyloxycarbonyl)-1-Pyrrolidine
  • (2S,4S)-2-(dimethylamino-carbonyl)-4-mercapto-1-(p-nitrobenzyloxycarbonyl)-1-pyrrolidine-1-(p-nitrobenzyloxycarbonyl)-1-pyrrolidine
  • (2S,4S)-2-Dimethylaminocarbonyl-4-mercapto-1-(p-nitrobenzyloxycarbonyl)-pyrrolidine
  • (2S,4S)-N,N-Dimethyl-1-(4-nitrobenzyloxycarbonyl)-4-mercaptopyrrolidine-2-carboxamide
  • (2S-Cis)-2-[(Dimethylamino)Carbonyl]-4-Mercapto-1-Pyrrolidinecarboxylic Acid (4-Nitrophenyl) Methyl Ester
  • (2S-cis)-2-[(dimethylamino)carbonyl]-4-mercapto-1-pyrrolidinecarboxylic acid
  • See more synonyms
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