Base information
| Cat. No. | |
| CAS No. | 64224-21-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6N2S3 |
| Molecular Weight | 226.342 |
| Exact Mass | 225.969 |
| XLogP3 | 3.3045 |
| Mr | 59.022 |
| PSA | 114.35 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | S=c1ssc(c1C)c1cnccn1 |
