CAS 6183-01-3

N-[2-(Benzoylthio)-1-oxopropyl]glycine

Description:

N-[2-(Benzoylthio)-1-oxopropyl]glycine, with the CAS number 6183-01-3, is an organic compound that features a glycine backbone modified with a benzoylthio group. This compound is characterized by its functional groups, which include an amine, a carboxylic acid, and a thioether, contributing to its potential reactivity and biological activity. The presence of the benzoylthio moiety suggests that it may exhibit properties related to thiol reactivity, potentially influencing its interactions in biological systems. The compound's structure allows for hydrogen bonding and dipole interactions, which can affect its solubility and stability in various solvents. Additionally, its molecular configuration may enable it to participate in various chemical reactions, making it of interest in synthetic organic chemistry and potentially in pharmaceutical applications. As with many compounds containing sulfur and carbonyl functionalities, it may also exhibit unique spectroscopic properties, useful for characterization through techniques such as NMR and IR spectroscopy.

Formula: C₁₂H₁₃NO₄S

InChI: InChI=1S/C12H13NO4S/c1-8(11(16)13-7-10(14)15)18-12(17)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,13,16)(H,14,15)

InChI key: InChIKey=CVAYIPQJWPRFDT-UHFFFAOYSA-N

SMILES: C(SC(C(NCC(O)=O)=O)C)(=O)C1=CC=CC=C1

Synonyms:

• Glycine, N-(2-mercaptopropionyl)-, benzoate (ester)
• Glycine, N-[2-(benzoylthio)-1-oxopropyl]-
• Benzoic acid, thio-, S-ester with N-(2-mercaptopropionyl)glycine
• Glycine, N-(2-mercaptopropionyl)-, benzoate
• N-[2-(Benzoylthio)-1-oxopropyl]glycine
• Tiopronin S-Benzoyl Impurity
• Nitroxynil Impurity 2

Tiopronin Impurity 5

CAS: 6183-01-3

Formula: C₁₂H₁₃NO₄S

Molecular weight: 267.30

Ref: 4Z-T-154015

S-Benzoyl Tiopronin-d5

Controlled Product

CAS: 6183-01-3

Applications S-Benzoyl Tiopronin-d5 is labelled S-Benzoyl Tiopronin (B209585) which is used to prepare radiolabeled platelet GPIIb/IIIa receptor antagonists as imaging agents for the diagnosis of thromboembolic disorders.
References DeGrado, W., et al.: PCT Int. Appl., WO 9422494 A1 19941013 (1994)

Formula: C₁₂D₅H₈NO₄S

Color and Shape: Neat

Molecular weight: 272.332

Ref: TR-B209587

S-Benzoyl Tiopronin

Controlled Product

CAS: 6183-01-3

Formula: C₁₂H₁₃NO₄S

Color and Shape: Neat

Molecular weight: 267.3

Ref: TR-B209585