14731-49-8

Basic information

• Product Name: 1,3,4-Thiadiazol-2-amine, N-(4-methylphenyl)-5-[(phenylmethyl)thio]-
• CAS NO: 14731-49-8
• Molecular Formula: C16H15N3S2
• Molecular Weight: 313.447
• Mol File: 14731-49-8.mol
• Article Data: 2

Chemical Properties

• CAS DataBase Reference: 1,3,4-Thiadiazol-2-amine, N-(4-methylphenyl)-5-[(phenylmethyl)thio]-(CAS DataBase Reference)
• NIST Chemistry Reference: 1,3,4-Thiadiazol-2-amine, N-(4-methylphenyl)-5-[(phenylmethyl)thio]-(14731-49-8)
• EPA Substance Registry System: 1,3,4-Thiadiazol-2-amine, N-(4-methylphenyl)-5-[(phenylmethyl)thio]-(14731-49-8)

Safety Data

• Hazardous Substances Data: 14731-49-8(Hazardous Substances Data)

Upstream product

• 79010-44-9 1-p-methylphenyl-2,5-dithiohydrazodicarbonamide 
• 100-44-7 benzyl chloride 
• 14731-25-0 2-(4'-methylphenylamino)-Δ²-1,3,4-thiadiazoline-5-thione 
• 57216-15-6 S-Benzylisothiosemicarbazide 
• 622-59-3 1-isothiocyanato-4-methylbenzene 
• 14731-25-0 5-(p-methylphenylamino)-1,3,4-thiadiazolium-2-thiolate 
• 79010-47-2 C₁₆H₁₈N₄S₂ 

Downstream Products

• 14731-56-7 (5-phenylmethanesulfonyl-[1,3,4]thiadiazol-2-yl)-p-tolyl-amine 

Relevant articles and documents

The route of alkylation of 5-substituted 1,3,4-thiadiazoline-2-thiones

The reaction of 5-anilino(toluidino-, morpholino)-1,3,4-thiadiazoline-2-thiones at 80°C with allyl bromide and benzyl chloride in alcohol, acetonitrile or DMF in the presence of KOH and also with phenoxymethyloxirane in alcohol in the absence of base gives the corresponding novel allyl-, benzyl-, and 2-hydroxy-3-phenoxypropyl products substituted at the exocyclic S atom. Alkylation of the indicated thiones with benzyl chloride at 150-153°C in DMF in the presence of KOH occurs similarly. Under these conditions, allyl bromide forms alkylation products at the endocyclic N(3) atom as a result of an S→N thio-Claisen rearrangement of the initially formed product which is allyl substituted at the exocyclic S atom.