EWU
Summary
| Name: | 6-azanyl-2-(2-methoxyethoxy)-9-(phenylmethyl)-7H-purin-8-one |
| Formula: | C15 H17 N5 O3 |
| Formal charge: | 0 |
| Formula weight: | 315.327 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6-azanyl-2-(2-methoxyethoxy)-9-(phenylmethyl)-7~{H}-purin-8-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H17N5O3/c1-22-7-8-23-14-18-12(16)11-13(19-14)20(15(21)17-11)9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,17,21)(H2,16,18,19) |
| InChIKey | InChI | 1.03 | YYCDGEZXHXHLGW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COCCOc1nc(N)c2NC(=O)N(Cc3ccccc3)c2n1 |
| SMILES | CACTVS | 3.385 | COCCOc1nc(N)c2NC(=O)N(Cc3ccccc3)c2n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COCCOc1nc(c2c(n1)N(C(=O)N2)Cc3ccccc3)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | COCCOc1nc(c2c(n1)N(C(=O)N2)Cc3ccccc3)N |
