AC1NLRME
ethyl 2-[(2-cyanoacetyl)amino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Also Known As: Oprea1_714210|ethyl 2-[(cyanoacetyl)amino]-5-[(dimethylamino)carbonyl]-4-methylthiophene-3-carboxylate|ETHYL 2-[(CYANOACETYL)AMINO]-5-[(DIMETHYLAMINO)-CARBONYL]-4-METHYLTHIOPHENE-3-CARBOXYLATE|ethyl 2-(2-cyanoacetamido)-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate|ethyl 2-[(2-cyanoacetyl)amino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate|Ethyl 2-[(2-cyanoacetyl)amino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate|ethyl 2-[(cyanoacetyl)amino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate|Ethyl 2-(cyanoacetyl)amino-5-(dimethylamino)carbonyl-4-methylthiophene-3-carboxylate|ethyl 5-(N,N-dimethylcarbamoyl)-2-(2-cyanoacetylamino)-4-methylthiophene-3-car boxylate|ethyl2-(2-cyanoacetamido)-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
| Molecular Formula | C14H17N3O4S |
|---|---|
| Molecular Weight | 323.09396 g/mol |
| LogP | 1.7872 |
| Topological Polar Surface Area | 99.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.09396 |
| Monoisotopic Mass | 323.09396 |
| Heavy Atoms | 22 |
| Complexity | 643.24854 |
Chemical Identifiers
| CAS Number | 545372-76-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)CC#N |
Product Overview
AC1NLRME (CAS 545372-76-7), with molecular formula C14H17N3O4S and molecular weight 323.09396 g/mol. IUPAC: ethyl 2-[(2-cyanoacetyl)amino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate.