0DF
Summary
| Name: | 1-methyl-6-phenyl-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one |
| Formula: | C13 H11 N3 O |
| Formal charge: | 0 |
| Formula weight: | 225.246 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-methyl-6-phenyl-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one |
| OpenEye OEToolkits | 1.7.6 | 1-methyl-6-phenyl-3H-imidazo[4,5-b]pyridin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C2Nc1ncc(cc1N2C)c3ccccc3 |
| InChI | InChI | 1.03 | InChI=1S/C13H11N3O/c1-16-11-7-10(9-5-3-2-4-6-9)8-14-12(11)15-13(16)17/h2-8H,1H3,(H,14,15,17) |
| InChIKey | InChI | 1.03 | PDYMCBRGMDRAPX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CN1C(=O)Nc2ncc(cc12)c3ccccc3 |
| SMILES | CACTVS | 3.370 | CN1C(=O)Nc2ncc(cc12)c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CN1c2cc(cnc2NC1=O)c3ccccc3 |
| SMILES | OpenEye OEToolkits | 1.7.6 | CN1c2cc(cnc2NC1=O)c3ccccc3 |
