AC1LY0MN
methyl (2E)-2-[(2Z)-2-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]acetate
Also Known As: (E)-methyl 2-((Z)-2-(1-cyano-2-oxo-2-(piperidin-1-yl)ethylidene)-4-oxo-3-phenylthiazolidin-5-ylidene)acetate|methyl (2E)-{(2Z)-2-[1-cyano-2-oxo-2-(piperidin-1-yl)ethylidene]-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene}ethanoate|methyl (2E)-2-[(2Z)-2-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]acetate|methyl 2-[2-(1-cyano-2-oxo-2-piperidylethylidene)-4-oxo-3-phenyl-1,3-thiazolid in-5-ylidene]acetate
| Molecular Formula | C20H19N3O4S |
|---|---|
| Molecular Weight | 397.10962 g/mol |
| LogP | 0.53928 |
| Topological Polar Surface Area | 92.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 397.10962 |
| Monoisotopic Mass | 397.10962 |
| Heavy Atoms | 28 |
| Complexity | 1103.0452 |
Chemical Identifiers
| CAS Number | 799809-82-8 |
|---|---|
| SMILES | COC(=O)/C=C/1\C(=O)N(/C(=C(\C#N)/C(=O)N2CCCCC2)/S1)C3=CC=CC=C3 |
Product Overview
AC1LY0MN (CAS 799809-82-8), with molecular formula C20H19N3O4S and molecular weight 397.10962 g/mol. IUPAC: methyl (2E)-2-[(2Z)-2-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]acetate.