A1AIA
Summary
| Name: | primidone |
| Synonyms: | 5-ethyl-5-phenyl-1,3-diazinane-4,6-dione |
| Formula: | C12 H14 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 218.252 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5-ethyl-5-phenyl-1,3-diazinane-4,6-dione |
| OpenEye OEToolkits | 2.0.7 | 5-ethyl-5-phenyl-1,3-diazinane-4,6-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CCC1(C(=O)NCNC1=O)c1ccccc1 |
| InChI | InChI | 1.06 | InChI=1S/C12H14N2O2/c1-2-12(9-6-4-3-5-7-9)10(15)13-8-14-11(12)16/h3-7H,2,8H2,1H3,(H,13,15)(H,14,16) |
| InChIKey | InChI | 1.06 | DQMZLTXERSFNPB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCC1(C(=O)NCNC1=O)c2ccccc2 |
| SMILES | CACTVS | 3.385 | CCC1(C(=O)NCNC1=O)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCC1(C(=O)NCNC1=O)c2ccccc2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCC1(C(=O)NCNC1=O)c2ccccc2 |
