Base information
| Cat. No. | |
| CAS No. | 55040-34-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H4N2OS |
| Molecular Weight | 176.195 |
| Exact Mass | 176.004 |
| XLogP3 | 1.46128 |
| Mr | 47.1607 |
| PSA | 84.89 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 17 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | N#Cc1c[nH]c(=O)c2c1scc2 |
