JYN
Summary
| Name: | 9-(4-azidobutyl)purin-6-amine |
| Formula: | C9 H12 N8 |
| Formal charge: | 0 |
| Formula weight: | 232.245 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 9-(4-azidobutyl)purin-6-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H12N8/c10-8-7-9(13-5-12-8)17(6-14-7)4-2-1-3-15-16-11/h5-6H,1-4H2,(H2,10,12,13) |
| InChIKey | InChI | 1.03 | HVEKFLZTZQALAB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1ncnc2n(CCCCN=[N+]=[N-])cnc12 |
| SMILES | CACTVS | 3.385 | Nc1ncnc2n(CCCCN=[N+]=[N-])cnc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1nc(c2c(n1)n(cn2)CCCCN=[N+]=[N-])N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1nc(c2c(n1)n(cn2)CCCCN=[N+]=[N-])N |
