49847-44-1

Usage

Uses

Used in Oil and Gas Industry:
1-Cyclohexyl-1H-tetrazole-5-thiol is used as a corrosion inhibitor to protect pipelines and equipment from corrosion, ensuring the smooth operation of oil and gas production processes.
Used in Pharmaceutical and Agrochemical Industries:
1-Cyclohexyl-1H-tetrazole-5-thiol is used as a protecting agent for mercaptans during the production of intermediate products. This helps in the synthesis of various pharmaceuticals and agrochemicals, enhancing their efficacy and safety.
Used in Plastics Industry:
1-Cyclohexyl-1H-tetrazole-5-thiol is used as a stabilizer for PVC, preventing the degradation of the polymer and improving its durability and performance in various applications.
Used in Dye and Pharmaceutical Production:
1-Cyclohexyl-1H-tetrazole-5-thiol serves as an intermediate in the production of dyes and pharmaceuticals, contributing to the development of new and improved products with enhanced properties.
Used in the Synthesis of Metal-Organic Frameworks and Coordination Polymers:
1-Cyclohexyl-1H-tetrazole-5-thiol has potential applications in the synthesis of metal-organic frameworks and coordination polymers, which are materials with unique properties and potential uses in various fields, such as gas storage, catalysis, and drug delivery.

InChI:InChI=1/C7H12N4S/c12-7-8-9-10-11(7)6-4-2-1-3-5-6/h6H,1-5H2,(H,8,10,12)

Upstream product

• 108-91-8 cyclohexylamine 
• 1122-82-3 isothiocyanatocyclohexane 
• 66654-55-5 N-cyclohexyl-1,2,3,4-thiatriazol-5-amine 
• 43009-21-8 Cyclohexyl-dithiocarbamic acid; compound with triethyl-amine 
• 66917-87-1 N-cyclohexyl(aminosulfanyl)carbothioamide 
• 21198-18-5 4-cyclohexyl-thiosemicarbazide 

Downstream Products

• 49846-70-0 3-cyclohexyl-6-hydroxy-6-methyl-6,7-dihydro-5H-tetrazolo[5,1-b][1,3]thiazinium; bromide 
• 330839-27-5 5-(2-(4-chlorophenoxy)ethylthio)-1-cyclohexyl-1H-tetrazole 
• 1618101-27-1 1-cyclohexyl-5-[(3,5-dinitrobenzyl)sulfonyl]-1H-tetrazole 
• 1618101-23-7 1-cyclohexyl-5-[(3,5-dinitrobenzyl)sulfinyl]-1H-tetrazole 
• 1618101-11-3 1-cyclohexyl-5-[(3,5-dinitrobenzyl)sulfanyl]-1H-tetrazole 
• 1618101-05-5 1-cyclohexyl-5-[(2,4-dinitrobenzyl)sulfanyl]-1H-tetrazole 
• 49847-41-8 3-cyclohexyl-6-hydroxy-6,7-dihydro-5H-tetrazolo[5,1-b][1,3]thiazinium; bromide 
• 88616-06-2 1-cyclohexyl-4-morpholin-4-ylmethyl-1,4-dihydro-tetrazole-5-thione 

Relevant academic research and scientific papers

Approaches to design non-covalent inhibitors for human granzyme B (hGrB)

A structure-based design campaign for non-covalent small molecule inhibitors of human granzyme B was carried out by means of a virtual screening strategy employing three constraints and probe site-mapping with FTMAP to identify ligand "hot spots". In addition, new scaffolds of diverse structures were subsequently explored with ROCS shape-based superposition methods, following by Glide SP docking, induced fit docking and analysis of QikProp molecular properties. Novel classes of moderately active small molecule blockers (≥25 μM IC50 values) from commercially available libraries were identified, and three novel scaffolds have been synthesized by multi-step procedures. Furthermore, we provide an example of a comprehensive structure-based drug discovery approach to non-covalent inhibitors that relies on the X-ray structure of a covalently bound ligand and suggest that the design path may be compromised by alternative and unknown binding poses. This journal is

A facile one-pot synthesis of 1-substituted tetrazole-5-thiones and 1-substituted 5-alkyl(aryl)sulfanyltetrazoles from organic isothiocyanates

Treatments of organic isothiocyanates (R-NCS) with NaN3 in the presence of pyridine in water at room temperature gave corresponding various organic tetrazole-thiones, [S=CN4(R)] (R = alkyl or aryl). Isolated products are obtained as white or yellow solids in good yields (76-97%). The molecular structure by X-ray diffraction study for one of products shows the proposed formation. In addition, one-pot synthesis of 1- substituted 5-alkyl(or aryl)sulfanyltetrazoles has been demonstrated. Addition of alkyl or aryl halides into the mixture of organic isothiocyanates, NaN3, and pyridine in water at room temperature exclusively formed 1- substituted 5-alkyl(or aryl)sulfanyltetrazoles (S-derivatives) in high yields.

Synthesis of unsymmetrical sulfides derived from tetrazole-5-thiols

A series of unsymmetrical sulfides derived from I-substituted tetrazole-5-thiols was prepared by fusion of the corresponding 1-R-tetrazole-5-thiol sodium salt with 1-R′-5-halotetrazole. The structure was confirmed by 1H NMR and 13C NMR spectra. The target compounds were prepared in 50-80% yields.

Product and preparation of 1H-tetrazole-5-thiol derivatives

The process for preparation of and the intermediate compounds such as 1H-tetrazole-5-thiol having the formula STR1 wherein R1 is alkyl, aminoalkyl, acylaminoalkyl, aryl, alkoxycarbonylaminoalkyl, halogen-substituted aryl or alkylamino-substituted aryl and R2 is hydrogen or arakyl, preferably benzyl. The compound is produced by reacting a substituted thiosemicarbazide with an aralkyl chloride, subjecting the resultant compound to diazotization, and reacting the resultant compound with a Friedel Crafts catalyst. Optionally, this may be further hydrolyzed when R1 is aminoalkyl and/or converted to conventional salts.