Base information
| Cat. No. | |
| CAS No. | 1111637-81-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7N3OS |
| Molecular Weight | 193.226 |
| Exact Mass | 193.031 |
| XLogP3 | 1.00458 |
| Mr | 48.282 |
| PSA | 91.94 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | O=CC(c1ccnc(n1)SC)C#N |
