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CAS 885277-73-6

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1,1-Dimethylethyl 2-(aminothioxomethyl)-5-phenyl-1-pyrrolidinecarboxylate

Description:
1,1-Dimethylethyl 2-(aminothioxomethyl)-5-phenyl-1-pyrrolidinecarboxylate, identified by its CAS number 885277-73-6, is a chemical compound that features a pyrrolidine ring, which is a five-membered cyclic amine. This compound contains a carboxylate functional group, indicating it has acidic properties, and an aminothioxomethyl substituent, which suggests potential reactivity due to the presence of sulfur and nitrogen atoms. The dimethyl group attached to the carbon chain contributes to its steric bulk, potentially influencing its reactivity and interactions with biological systems. The phenyl group indicates that the compound may exhibit aromatic characteristics, which can affect its stability and solubility. Overall, this compound may have applications in medicinal chemistry or as a synthetic intermediate, but specific properties such as solubility, melting point, and biological activity would require empirical investigation for a comprehensive understanding.
Formula:C16H22N2O2S
InChI:InChI=1S/C16H22N2O2S/c1-16(2,3)20-15(19)18-12(9-10-13(18)14(17)21)11-7-5-4-6-8-11/h4-8,12-13H,9-10H2,1-3H3,(H2,17,21)
InChI key:InChIKey=WEBIJDMCKKACQD-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1C(CCC1C(N)=S)C2=CC=CC=C2
Synonyms:
  • 1,1-Dimethylethyl 2-(aminothioxomethyl)-5-phenyl-1-pyrrolidinecarboxylate
  • 1-Boc-2-Phenyl-5-Thiocarbamoyl-Pyrrolidine
  • 1-Pyrrolidinecarboxylic acid, 2-(aminothioxomethyl)-5-phenyl-, 1,1-dimethylethyl ester
  • 2-Phenyl-5-Thiocarbamoyl-Pyrrolidine-1-Carboxylic Acid Tert-Butyl Ester
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