E7R
Summary
| Name: | 1,3-dimethyl-7-propyl-purine-2,6-dione |
| Formula: | C10 H14 N4 O2 |
| Formal charge: | 0 |
| Formula weight: | 222.244 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1,3-dimethyl-7-propyl-purine-2,6-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H14N4O2/c1-4-5-14-6-11-8-7(14)9(15)13(3)10(16)12(8)2/h6H,4-5H2,1-3H3 |
| InChIKey | InChI | 1.03 | HGFWMGARSDHJFP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCn1cnc2N(C)C(=O)N(C)C(=O)c12 |
| SMILES | CACTVS | 3.385 | CCCn1cnc2N(C)C(=O)N(C)C(=O)c12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCn1cnc2c1C(=O)N(C(=O)N2C)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCn1cnc2c1C(=O)N(C(=O)N2C)C |
