9BS
Summary
| Name: | 2-(pyridin-2-yl)pyrimidine |
| Formula: | C9 H7 N3 |
| Formal charge: | 0 |
| Formula weight: | 157.172 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-(pyridin-2-yl)pyrimidine |
| OpenEye OEToolkits | 2.0.6 | 2-pyridin-2-ylpyrimidine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n2c(c1ncccc1)nccc2 |
| InChI | InChI | 1.03 | InChI=1S/C9H7N3/c1-2-5-10-8(4-1)9-11-6-3-7-12-9/h1-7H |
| InChIKey | InChI | 1.03 | YJVKLLJCUMQBHN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | c1ccc(nc1)c2ncccn2 |
| SMILES | CACTVS | 3.385 | c1ccc(nc1)c2ncccn2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccnc(c1)c2ncccn2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccnc(c1)c2ncccn2 |
