AC1MW30H
ethyl 4-[[2-[1-ethyl-5-oxo-2-sulfanylidene-3-(thiophen-2-ylmethyl)imidazolidin-4-yl]acetyl]amino]benzoate
Also Known As: A3239/0137577|ethyl 4-({[1-ethyl-5-oxo-3-(thiophen-2-ylmethyl)-2-thioxoimidazolidin-4-yl]acetyl}amino)benzoate|ethyl 4-(2-(1-ethyl-5-oxo-3-(thiophen-2-ylmethyl)-2-thioxoimidazolidin-4-yl)acetamido)benzoate|ETHYL 4-(2-{1-ETHYL-5-OXO-2-SULFANYLIDENE-3-[(THIOPHEN-2-YL)METHYL]IMIDAZOLIDIN-4-YL}ACETAMIDO)BENZOATE|ethyl 4-[[2-[1-ethyl-5-oxo-2-sulfanylidene-3-(thiophen-2-ylmethyl)imidazolidin-4-yl]acetyl]amino]benzoate
| Molecular Formula | C21H23N3O4S2 |
|---|---|
| Molecular Weight | 445.113 g/mol |
| LogP | 3.2712 |
| Topological Polar Surface Area | 78.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 445.113 |
| Monoisotopic Mass | 445.113 |
| Heavy Atoms | 30 |
| Complexity | 928.2379 |
Chemical Identifiers
| CAS Number | 1024592-95-7 |
|---|---|
| SMILES | CCN1C(=O)C(N(C1=S)CC2=CC=CS2)CC(=O)NC3=CC=C(C=C3)C(=O)OCC |
Product Overview
AC1MW30H (CAS 1024592-95-7), with molecular formula C21H23N3O4S2 and molecular weight 445.113 g/mol. IUPAC: ethyl 4-[[2-[1-ethyl-5-oxo-2-sulfanylidene-3-(thiophen-2-ylmethyl)imidazolidin-4-yl]acetyl]amino]benzoate.
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