Base information
| Cat. No. | |
| CAS No. | 80680-05-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H13N5O2S |
| Molecular Weight | 279.318 |
| Exact Mass | 279.079 |
| XLogP3 | 2.8259 |
| Mr | 75.728 |
| PSA | 117.66 |
| Sequence | - |
| Atom number | 32 |
| Bond number | 33 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCc1nnc(s1)/C(=C/c1ncc(n1C)[N+](=O)[O-])/C |