Base information
| Cat. No. | |
| CAS No. | 53551-23-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H11NOS |
| Molecular Weight | 181.255 |
| Exact Mass | 181.056 |
| XLogP3 | 2.159 |
| Mr | 51.1592 |
| PSA | 54.4 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 23 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CNC(=O)c1ccc(cc1)SC |
