structure of 2-[(2-amino-4-methyl-1,3-thiazol-5-yl)sulfanyl]acetonitrile

2-[(2-amino-4-methyl-1,3-thiazol-5-yl)sulfanyl]acetonitrile

CAS No.: 1000933-55-0
M. Wt: 185.3
M. Fa: C6H7N3S2
InChI Key: -

Names and Identifiers of 1000933-55-0

CAS Number

1000933-55-0

IUPAC Name

2-[(2-azanyl-4-methyl-1,3-thiazol-5-yl)sulfanyl]ethanenitrile

Canonical SMILES

CC1=C(SC(=N1)N)SCC#N

Physical and chemical properties of 1000933-55-0

Acidity coefficient

4.52±0.10(Predicted)

Boiling Point

375.4±37.0 °C(Predicted)

Density

1.39±0.1 g/cm3(Predicted)

Molecular Formula

C6H7N3S2

Molecular Weight

185.3

Safety Information of 1000933-55-0

Pictograms

Signal Word

 Warning

Safety Data Sheet
Supports customized editing of SDS information and downloading in PDF documents.

Applications of 1000933-55-0

The compound has potential applications in various fields:

  • Pharmaceutical Development: As a precursor for synthesizing novel antibacterial and anti-inflammatory agents.
  • Agricultural Chemistry: In the development of agrochemicals due to its biological activity against pests.
  • Material Science: Potential use in creating functional materials due to its unique chemical properties.

Interaction Studies of 1000933-55-0

Research on the interactions of 2-[(2-Amino-4-methyl-1,3-thiazol-5-yl)sulfanyl]acetonitrile with biological targets has shown promising results in modulating enzyme activity and influencing cellular pathways. Studies indicate that this compound may interact with proteins involved in inflammatory responses and microbial resistance mechanisms, highlighting its potential as a lead compound for drug development.

Biological Activity of 1000933-55-0

2-[(2-Amino-4-methyl-1,3-thiazol-5-yl)sulfanyl]acetonitrile exhibits a range of biological activities. Notably, it has been identified as an antagonist against the enzyme UDP-N-acetylmuramate/L-alanine ligase, which plays a critical role in bacterial cell wall synthesis. This interaction suggests potential applications in developing antibacterial agents. Additionally, thiazole derivatives are known to influence various biochemical pathways, including those related to inflammation and cancer.