AC1MG9PT
ethyl 5-benzyl-2-[(2,6-dimethylmorpholine-4-carbothioyl)amino]thiophene-3-carboxylate
Also Known As: ethyl 2-{[(2,6-dimethylmorpholin-4-yl)thioxomethyl]amino}-5-benzylthiophene-3- carboxylate|ethyl 5-benzyl-2-(2,6-dimethylmorpholine-4-carbothioamido)thiophene-3-carboxylate|ethyl 5-benzyl-2-[(2,6-dimethylmorpholine-4-carbothioyl)amino]thiophene-3-carboxylate|ethyl 5-benzyl-2-{[(2,6-dimethylmorpholin-4-yl)carbonothioyl]amino}thiophene-3-carboxylate
| Molecular Formula | C21H26N2O3S2 |
|---|---|
| Molecular Weight | 418.1385 g/mol |
| LogP | 4.3216 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.1385 |
| Monoisotopic Mass | 418.1385 |
| Heavy Atoms | 28 |
| Complexity | 812.3131 |
Chemical Identifiers
| CAS Number | 588697-83-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)N3CC(OC(C3)C)C |
Product Overview
AC1MG9PT (CAS 588697-83-0), with molecular formula C21H26N2O3S2 and molecular weight 418.1385 g/mol. IUPAC: ethyl 5-benzyl-2-[(2,6-dimethylmorpholine-4-carbothioyl)amino]thiophene-3-carboxylate.
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