Q1K
Summary
| Name: | 6-(4-methylsulfonylpiperazin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine |
| Formula: | C10 H14 N6 O2 S |
| Formal charge: | 0 |
| Formula weight: | 282.322 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6-(4-methylsulfonylpiperazin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H14N6O2S/c1-19(17,18)15-6-4-14(5-7-15)10-3-2-9-12-11-8-16(9)13-10/h2-3,8H,4-7H2,1H3 |
| InChIKey | InChI | 1.03 | UNYVOSROGSXTRY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[S](=O)(=O)N1CCN(CC1)c2ccc3nncn3n2 |
| SMILES | CACTVS | 3.385 | C[S](=O)(=O)N1CCN(CC1)c2ccc3nncn3n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CS(=O)(=O)N1CCN(CC1)c2ccc3nncn3n2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CS(=O)(=O)N1CCN(CC1)c2ccc3nncn3n2 |
