Base information
| Cat. No. | |
| CAS No. | 521972-99-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H5NO2S2 |
| Molecular Weight | 211.261 |
| Exact Mass | 210.976 |
| XLogP3 | 2.0972 |
| Mr | 58.5977 |
| PSA | 99.63 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | S=C1NC(=O)/C(=C/c2ccco2)/S1 |
