Base information
| Cat. No. | |
| CAS No. | 86-93-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6N4S |
| Molecular Weight | 178.214 |
| Exact Mass | 178.031 |
| XLogP3 | 1.3249 |
| Mr | 46.5437 |
| PSA | 78.59 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | S=c1nn[nH]n1c1ccccc1 |
