B6T
Summary
| Name: | 8-oxidanyl-6-phenyl-7-propan-2-yl-imidazo[1,2-b]pyridazine-3-carbonitrile |
| Formula: | C16 H14 N4 O |
| Formal charge: | 0 |
| Formula weight: | 278.309 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 8-oxidanyl-6-phenyl-7-propan-2-yl-imidazo[1,2-b]pyridazine-3-carbonitrile |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H14N4O/c1-10(2)13-14(11-6-4-3-5-7-11)19-20-12(8-17)9-18-16(20)15(13)21/h3-7,9-10,21H,1-2H3 |
| InChIKey | InChI | 1.03 | WZFZMEFQZHKQIH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)c1c(O)c2ncc(C#N)n2nc1c3ccccc3 |
| SMILES | CACTVS | 3.385 | CC(C)c1c(O)c2ncc(C#N)n2nc1c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(C)c1c(c2ncc(n2nc1c3ccccc3)C#N)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(C)c1c(c2ncc(n2nc1c3ccccc3)C#N)O |
