Base information
| Cat. No. | |
| CAS No. | 88918-76-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H13N3O2S |
| Molecular Weight | 263.316 |
| Exact Mass | 263.073 |
| XLogP3 | 2.75488 |
| Mr | 69.3594 |
| PSA | 94.13 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 32 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CNS(=O)(=O)Cc1ccc2c(c1)c(CC#N)c[nH]2 |
