Epalrestat Impurity 3
ethyl 2-[5-(2-methyl-3-phenylprop-2-enylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate
Also Known As: Epalrestat Impurity 3|Ethyl 2-(5-(2-methyl-3-phenylallylidene)-4-oxo-2-thioxothiazolidin-3-yl)acetate|ethyl 2-[5-(2-methyl-3-phenylprop-2-en-1-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate|ethyl 2-[5-(2-methyl-3-phenylprop-2-enylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate
| Molecular Formula | C17H17NO3S2 |
|---|---|
| Molecular Weight | 347.06497 g/mol |
| LogP | 3.3972 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.06497 |
| Monoisotopic Mass | 347.06497 |
| Heavy Atoms | 23 |
| Complexity | 680.3387 |
Chemical Identifiers
| CAS Number | 682775-71-9 |
|---|---|
| SMILES | CCOC(=O)CN1C(=O)C(=CC(=CC2=CC=CC=C2)C)SC1=S |
Product Overview
Epalrestat Impurity 3 (CAS 682775-71-9), with molecular formula C17H17NO3S2 and molecular weight 347.06497 g/mol. IUPAC: ethyl 2-[5-(2-methyl-3-phenylprop-2-enylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate.
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