Base information
| Cat. No. | |
| CAS No. | 5147-80-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6N2S2 |
| Molecular Weight | 170.255 |
| Exact Mass | 169.997 |
| XLogP3 | 1.97116 |
| Mr | 45.162 |
| PSA | 98.18 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 15 |
| Ring number | 0 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CSC(=C(C#N)C#N)SC |
