Base information
| Cat. No. | |
| CAS No. | 88650-97-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H16N6O2S |
| Molecular Weight | 380.424 |
| Exact Mass | 380.106 |
| XLogP3 | 5.88308 |
| Mr | 107.437 |
| PSA | 138.7 |
| Sequence | - |
| Atom number | 43 |
| Bond number | 45 |
| Ring number | 3 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | N#CCCN(c1ccc(cc1)/N=N/c1nc2c(s1)cc(cc2)[N+](=O)[O-])CC |
