Base information
| Cat. No. | |
| CAS No. | 412341-42-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H5N3OS |
| Molecular Weight | 179.199 |
| Exact Mass | 179.015 |
| XLogP3 | 0.9807 |
| Mr | 47.5484 |
| PSA | 93.63 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 18 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | S=c1[nH]c2cnccc2c(=O)[nH]1 |
