Base information
| Cat. No. | |
| CAS No. | 21346-36-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6N2OS |
| Molecular Weight | 190.222 |
| Exact Mass | 190.02 |
| XLogP3 | 2.0176 |
| Mr | 50.7325 |
| PSA | 71.09 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=Cc1cnc(s1)c1ccncc1 |
