Base information
| Cat. No. | |
| CAS No. | 51988-14-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6N2OS3 |
| Molecular Weight | 254.352 |
| Exact Mass | 253.964 |
| XLogP3 | 3.1332 |
| Mr | 63.9282 |
| PSA | 131.38 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | O=C(c1ccccc1)Sc1n[nH]c(=S)s1 |
