Base information
| Cat. No. | |
| CAS No. | 1089704-57-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8N2O2S |
| Molecular Weight | 208.237 |
| Exact Mass | 208.031 |
| XLogP3 | 1.868 |
| Mr | 53.5015 |
| PSA | 80.32 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 23 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1nc2c(s1)nccc2 |
