DYZ
Summary
| Name: | 7-ethyl-3-(phenylmethyl)purine-2,6-dione |
| Formula: | C14 H14 N4 O2 |
| Formal charge: | 0 |
| Formula weight: | 270.287 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 7-ethyl-3-(phenylmethyl)purine-2,6-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C14H14N4O2/c1-2-17-9-15-12-11(17)13(19)16-14(20)18(12)8-10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H,16,19,20) |
| InChIKey | InChI | 1.03 | XEPOHOPPWDSWQR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCn1cnc2N(Cc3ccccc3)C(=O)NC(=O)c12 |
| SMILES | CACTVS | 3.385 | CCn1cnc2N(Cc3ccccc3)C(=O)NC(=O)c12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCn1cnc2c1C(=O)NC(=O)N2Cc3ccccc3 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCn1cnc2c1C(=O)NC(=O)N2Cc3ccccc3 |
