Base information
| Cat. No. | |
| CAS No. | 505-44-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H9NOS2 |
| Molecular Weight | 163.261 |
| Exact Mass | 163.013 |
| XLogP3 | 1.7235 |
| Mr | 43.5885 |
| PSA | 80.73 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 17 |
| Ring number | 0 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | S=C=NCCCS(=O)C |
