Base information
| Cat. No. | |
| CAS No. | 66474-36-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H15N7O4S3 |
| Molecular Weight | 453.519 |
| Exact Mass | 453.035 |
| XLogP3 | 0.14008 |
| Mr | 110.024 |
| PSA | 230 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 46 |
| Ring number | 3 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | N#C/C=C\SCC(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)CSc1nnnn1C |
