W5M
Summary
| Name: | 9-methyl-9H-purine-2,6-diamine |
| Formula: | C6 H8 N6 |
| Formal charge: | 0 |
| Formula weight: | 164.168 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 9-methyl-9H-purine-2,6-diamine |
| OpenEye OEToolkits | 2.0.7 | 9-methylpurine-2,6-diamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Cn2cnc1c(nc(N)nc12)N |
| InChI | InChI | 1.03 | InChI=1S/C6H8N6/c1-12-2-9-3-4(7)10-6(8)11-5(3)12/h2H,1H3,(H4,7,8,10,11) |
| InChIKey | InChI | 1.03 | NMJOZGVQPPGGFV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1cnc2c(N)nc(N)nc12 |
| SMILES | CACTVS | 3.385 | Cn1cnc2c(N)nc(N)nc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cn1cnc2c1nc(nc2N)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cn1cnc2c1nc(nc2N)N |
