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CAS 519016-62-7

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2-(1,1-Dimethylethyl) 4-ethyl 5-[(2-chloroacetyl)amino]-3-methyl-2,4-thiophenedicarboxylate

Description:
2-(1,1-Dimethylethyl) 4-ethyl 5-[(2-chloroacetyl)amino]-3-methyl-2,4-thiophenedicarboxylate, with the CAS number 519016-62-7, is a synthetic organic compound characterized by its complex structure featuring a thiophene ring, which is a five-membered aromatic heterocycle containing sulfur. This compound includes multiple functional groups, such as carboxylate esters and an amide, which contribute to its chemical reactivity and potential biological activity. The presence of the chloroacetyl group suggests that it may participate in nucleophilic substitution reactions, making it of interest in medicinal chemistry. The bulky tert-butyl and ethyl substituents can influence the compound's solubility and steric properties, potentially affecting its interaction with biological targets. Overall, this compound may exhibit unique pharmacological properties, warranting further investigation for applications in drug development or as a chemical intermediate in organic synthesis. Its specific characteristics, such as melting point, boiling point, and solubility, would require empirical measurement or literature reference for precise values.
Formula:C15H20ClNO5S
InChI:InChI=1S/C15H20ClNO5S/c1-6-21-13(19)10-8(2)11(14(20)22-15(3,4)5)23-12(10)17-9(18)7-16/h6-7H2,1-5H3,(H,17,18)
InChI key:InChIKey=USPKEMCMMCHUTO-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C1=C(NC(CCl)=O)SC(C(OC(C)(C)C)=O)=C1C
Synonyms:
  • 2,4-Thiophenedicarboxylic acid, 5-[(2-chloroacetyl)amino]-3-methyl-, 2-(1,1-dimethylethyl) 4-ethyl ester
  • 2,4-Thiophenedicarboxylic acid, 5-[(chloroacetyl)amino]-3-methyl-, 2-(1,1-dimethylethyl) 4-ethyl ester
  • 2-(1,1-Dimethylethyl) 4-ethyl 5-[(2-chloroacetyl)amino]-3-methyl-2,4-thiophenedicarboxylate
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