Base information
| Cat. No. | |
| CAS No. | 31618-80-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H8N2S |
| Molecular Weight | 164.228 |
| Exact Mass | 164.041 |
| XLogP3 | 2.4466 |
| Mr | 46.8667 |
| PSA | 56.92 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Cc1n[nH]c(c1)c1cccs1 |
