O0S
Summary
| Name: | N-{4-[(pyrimidin-2-yl)oxy]phenyl}acetamide |
| Formula: | C12 H11 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 229.235 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-{4-[(pyrimidin-2-yl)oxy]phenyl}acetamide |
| OpenEye OEToolkits | 2.0.6 | ~{N}-(4-pyrimidin-2-yloxyphenyl)ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n1cccnc1Oc2ccc(NC(C)=O)cc2 |
| InChI | InChI | 1.03 | InChI=1S/C12H11N3O2/c1-9(16)15-10-3-5-11(6-4-10)17-12-13-7-2-8-14-12/h2-8H,1H3,(H,15,16) |
| InChIKey | InChI | 1.03 | DXVKZDBYLFVMFB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1ccc(Oc2ncccn2)cc1 |
| SMILES | CACTVS | 3.385 | CC(=O)Nc1ccc(Oc2ncccn2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(=O)Nc1ccc(cc1)Oc2ncccn2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(=O)Nc1ccc(cc1)Oc2ncccn2 |
