CAS 99254-22-5

Ethyl 4-[(2-mercaptoacetyl)amino]benzoate

Description:

Ethyl 4-[(2-mercaptoacetyl)amino]benzoate, with the CAS number 99254-22-5, is an organic compound characterized by its ester functional group and the presence of a mercaptoacetyl amino group. This compound features a benzoate moiety, which contributes to its aromatic properties, and an ethyl group that enhances its solubility in organic solvents. The mercaptoacetyl group introduces a thiol (-SH) functionality, which can participate in various chemical reactions, including nucleophilic substitutions and redox reactions. Ethyl 4-[(2-mercaptoacetyl)amino]benzoate may exhibit biological activity, making it of interest in medicinal chemistry and drug development. Its structure suggests potential applications in synthesizing other compounds or as a reagent in organic synthesis. Additionally, the presence of both the ester and thiol groups may influence its reactivity and stability under different conditions. Overall, this compound's unique functional groups and structural features make it a subject of interest in various chemical and pharmaceutical research fields.

Formula: C₁₁H₁₃NO₃S

InChI: InChI=1S/C11H13NO3S/c1-2-15-11(14)8-3-5-9(6-4-8)12-10(13)7-16/h3-6,16H,2,7H2,1H3,(H,12,13)

InChI key: InChIKey=GTRWTNRJZGIRDE-UHFFFAOYSA-N

SMILES: N(C(CS)=O)C1=CC=C(C(OCC)=O)C=C1

Synonyms:

• Benzoic acid, 4-[(2-mercaptoacetyl)amino]-, ethyl ester
• Benzoic acid, 4-[(mercaptoacetyl)amino]-, ethyl ester
• Ethyl 4-(mercaptoacetamido)benzoate
• Ethyl 4-[(2-mercaptoacetyl)amino]benzoate
• N-(4-Ethoxycarbonylphenyl)-α-mercaptoacetamide