KC3
Summary
| Name: | 3-methyl-6-(4-methylpiperidin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine |
| Formula: | C12 H17 N5 |
| Formal charge: | 0 |
| Formula weight: | 231.297 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-methyl-6-(4-methylpiperidin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C12H17N5/c1-9-5-7-16(8-6-9)12-4-3-11-14-13-10(2)17(11)15-12/h3-4,9H,5-8H2,1-2H3 |
| InChIKey | InChI | 1.06 | NODJHUWKRQTQFX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC1CCN(CC1)c2ccc3nnc(C)n3n2 |
| SMILES | CACTVS | 3.385 | CC1CCN(CC1)c2ccc3nnc(C)n3n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1nnc2n1nc(cc2)N3CCC(CC3)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1nnc2n1nc(cc2)N3CCC(CC3)C |
