V2Z
Summary
| Name: | 3-PROPYL-5-(3-PYRIDYL)-1H-PYRAZIN-2-ONE |
| Formula: | C12 H13 N3 O |
| Formal charge: | 0 |
| Formula weight: | 215.251 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.7.6 | 3-propyl-5-pyridin-3-yl-1H-pyrazin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H13N3O/c1-2-4-10-12(16)14-8-11(15-10)9-5-3-6-13-7-9/h3,5-8H,2,4H2,1H3,(H,14,16) |
| InChIKey | InChI | 1.03 | ZKLHKFWUNCAKLE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCC1=NC(=CNC1=O)c2cccnc2 |
| SMILES | CACTVS | 3.385 | CCCC1=NC(=CNC1=O)c2cccnc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCCC1=NC(=CNC1=O)c2cccnc2 |
| SMILES | OpenEye OEToolkits | 1.7.6 | CCCC1=NC(=CNC1=O)c2cccnc2 |
