Base information
| Cat. No. | |
| CAS No. | 14443-37-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6N4O2S |
| Molecular Weight | 198.202 |
| Exact Mass | 198.021 |
| XLogP3 | -0.3386 |
| Mr | 49.0561 |
| PSA | 119.7 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CSc1[nH]c(=O)c2c(n1)[nH]c(=O)[nH]2 |
