5-Thiazolecarboxamide, 4-amino-2,3-dihydro-3-phenyl-2-thioxo-

Base Information

• Chemical Name: 5-Thiazolecarboxamide, 4-amino-2,3-dihydro-3-phenyl-2-thioxo-
• CAS No.: 7157-92-8
• Molecular Formula: C10H9N3OS2
• Molecular Weight: 251.333
• DSSTox Substance ID: DTXSID60350331
• Wikidata: Q82126203

Synonyms:7157-92-8;5-Thiazolecarboxamide, 4-amino-2,3-dihydro-3-phenyl-2-thioxo-;4-amino-3-phenyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide;4-amino-3-phenyl-2-thioxo-2,3-dihydro-1,3-thiazole-5-carboxamide;4-amino-3-phenyl-2-sulfanylidene-1,3-thiazole-5-carboxamide;TimTec1_005145;Oprea1_842818;Oprea1_862302;DTXSID60350331;HMS1548J19;STK336303;4-Amino-3-phenyl-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide;AKOS000287856;CCG-199176;AB00685339-01;SR-01000560996;4-amino-5-carbamoyl-3-phenylthiazole-2(3h)-thione;SR-01000560996-1;F0862-0520;4-amino-3-phenyl-2-thioxo-2,3-dihydrothiazole-5-carboxamide

Chemical Property of 5-Thiazolecarboxamide, 4-amino-2,3-dihydro-3-phenyl-2-thioxo-

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 251.01870427
• Heavy Atom Count: 16
• Complexity: 361

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)N2C(=C(SC2=S)C(=O)N)N

Technology Process of 5-Thiazolecarboxamide, 4-amino-2,3-dihydro-3-phenyl-2-thioxo-

There total 1 articles about 5-Thiazolecarboxamide, 4-amino-2,3-dihydro-3-phenyl-2-thioxo- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 68.0%

phenyl isothiocyanate (103-72-0) + cyanoacetic acid amide (107-91-5) → 4-amino-5-aminocarbonyl-3-phenyl-2,3-dihydro-[1,3]thiazole-2-thione (7157-92-8)

Guidance literature:

With sulfur; triethylamine; In N,N-dimethyl-formamide; for 3h; Heating;

Reference yield: 85.0%

4-amino-5-aminocarbonyl-3-phenyl-2,3-dihydro-[1,3]thiazole-2-thione (7157-92-8) → 3-phenyl-2-thioxo-thiazolo<5,4-d><1,2,3>triazin-7-one (141622-14-2)

Guidance literature:

With acetic acid; sodium nitrite; In water; for 5h;

Reference yield: 80.0%

acetic anhydride (108-24-7) + 4-amino-5-aminocarbonyl-3-phenyl-2,3-dihydro-[1,3]thiazole-2-thione (7157-92-8) → 5-methyl-3-phenyl-2,3-dihydro-2-thioxothiazolo[4,5-d]pyrimidine-7(6H)-one (141622-32-4)

Guidance literature:

for 3h; Heating;

DOI:10.1016/0223-5234(93)90002-V

upstream raw materials:

phenyl isothiocyanate

cyanoacetic acid amide

Downstream raw materials:

3-phenyl-2-thioxo-2,3-dihydrothiazolo<4,5-d>pyrimidin-7(6H)-one

5-methyl-3-phenyl-2,3-dihydro-2-thioxothiazolo[4,5-d]pyrimidine-7(6H)-one

3,5-Diphenyl-2-thioxo-2,3-dihydro-6H-thiazolo[4,5-d]pyrimidin-7-one

5-(4-Methoxy-phenyl)-3-phenyl-2-thioxo-2,3-dihydro-6H-thiazolo[4,5-d]pyrimidin-7-one

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