4921-90-8

Basic information

• Product Name: N-(1,3-benzothiazol-2-yl)-N'-benzoylthiourea
• Synonyms: N-(1,3-benzothiazol-2-yl)-N'-benzoylthiourea
• CAS NO: 4921-90-8
• Molecular Formula: C₁₅H₁₁N₃OS₂
• Molecular Weight: 313.39734
• Mol File: 4921-90-8.mol
• Article Data: 7

Chemical Properties

• Appearance: /
• CAS DataBase Reference: N-(1,3-benzothiazol-2-yl)-N'-benzoylthiourea(CAS DataBase Reference)
• NIST Chemistry Reference: N-(1,3-benzothiazol-2-yl)-N'-benzoylthiourea(4921-90-8)
• EPA Substance Registry System: N-(1,3-benzothiazol-2-yl)-N'-benzoylthiourea(4921-90-8)

Safety Data

• Hazardous Substances Data: 4921-90-8(Hazardous Substances Data)

Upstream product

• 62-53-3 aniline 
• 65-85-0 benzoic acid 
• 98-88-4 benzoyl chloride 
• 136-95-8 2-amino-benzthiazole 
• 532-55-8 Benzoyl isothiocyanate 

Downstream Products

• 1537865-68-1 N-[3-(benzo[d]thiazol-2-yl)-4-methylthiazol-2(3H)-ylidene]benzamide 
• 5005-14-1 N-(benzo[d]thiazol-2-yl)benzamide 
• 3878-45-3 triphenylphosphine sulfide 
• 131120-23-5 N-Benzo[4,5]thiazolo[3,2-b][1,2,4]thiadiazol-(2Z)-ylidene-benzamide 
• 14294-12-3 1-(1,3-benzothiazol-2-yl)thiourea 

Relevant articles and documents

A novel gold(I)-mediated intramolecular transamidation of benzoyl thiourea derivatives to form benzamides via dethiocyanation

A novel gold(I)-mediated intramolecular transamidation of thiourea derivatives to yield benzamides via dethiocyanation have been achieved by the reaction of 3-(1,3-benzothiazol-2-yl)-1-(benzoyl)thiourea derivatives in the presence of gold(I) precursors. The compounds have been characterized using IR, NMR, GC-MS and microanalysis. The single crystal XRD of 3-(1,3-benzothiazol-2-yl)-1-(3-bromobenzoyl)thiourea (5), 3-(1,3-benzothiazol-2-yl)-1-(3-methoxybenzoyl)thiourea (6), N-(benzothiazol-2-yl)benzamide (10), N-(benzothiazol-2-yl)-3-chlorobenzamide (11), N-(benzothiazol-2-yl)-4-nitrobenzamide (12), N-(benzothiazol-2-yl)-3-bromobenzamide (14) have been discussed. The novel transformation is thought to proceed by a gold(I)-mediated intramolecular transamidation reaction which releases thiocyanate to yield the benzamide. Density functional theory calculations have been used to support the proposed mechanism for this transformation.

OPIOID RECEPTOR MODULATORS AND USE THEREOF

Disclosed is an in vitro screening method for identifying an antagonist-to-agonist allosteric modifier of a mu-opioid receptor and an in vivo method for confirming that a test compound is such a modifier of a mu-opioid receptor. Also disclosed is a method

Synthesis, characterization and biological evaluation of some thiourea derivatives bearing benzothiazole moiety as potential antimicrobial and anticancer agents

Five series of thiourea derivatives bearing benzothiazole moiety (20 compounds) were efficiently synthesized and evaluated for antimicrobial and anticancer activities. The results indicated that the compounds possessed a broad spectrum of activity against the tested microorganisms and showed higher activity against fungi than bacteria. Compounds 1b, 2b, 3b, 4b and 5b exhibited the greatest antimicrobial activity. Preliminary study of the structure-activity relationship revealed that electronic factors in benzothiazole rings had a great effect on the antimicrobial activity of these compounds. In preliminary MTT cytotoxicity studies, the thiourea derivatives (2d, 5c and 5d) were found most potent. In MCF-7 and HeLa cells, the IC50 values were observed in the range of 18-26?μM and 38-46?μM, respectively.