Base information
| Cat. No. | |
| CAS No. | 113-59-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H18ClNS |
| Molecular Weight | 315.86 |
| Exact Mass | 315.085 |
| XLogP3 | 5.188 |
| Mr | 92.277 |
| PSA | 28.54 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 41 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CN(CC/C=C\1/c2ccccc2Sc2c1cc(Cl)cc2)C |
