Base information
| Cat. No. | |
| CAS No. | 391248-15-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H14N2O2S |
| Molecular Weight | 214.285 |
| Exact Mass | 214.078 |
| XLogP3 | 1.75788 |
| Mr | 59.126 |
| PSA | 78.63 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 28 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | N#C[C@@H]1CSCN1C(=O)OC(C)(C)C |
