A1EN4
Summary
| Name: | 3-(2,4-dimethoxyphenyl)-6-[(5-methylimidazol-1-yl)methyl]-1H-pyridin-2-one |
| Formula: | C18 H19 N3 O3 |
| Formal charge: | 0 |
| Formula weight: | 325.362 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-(2,4-dimethoxyphenyl)-6-[(5-methylimidazol-1-yl)methyl]-1~{H}-pyridin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C18H19N3O3/c1-12-9-19-11-21(12)10-13-4-6-16(18(22)20-13)15-7-5-14(23-2)8-17(15)24-3/h4-9,11H,10H2,1-3H3,(H,20,22) |
| InChIKey | InChI | 1.06 | ZECHXPHSMKLWSM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(c(OC)c1)C2=CC=C(Cn3cncc3C)NC2=O |
| SMILES | CACTVS | 3.385 | COc1ccc(c(OC)c1)C2=CC=C(Cn3cncc3C)NC2=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cncn1CC2=CC=C(C(=O)N2)c3ccc(cc3OC)OC |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cncn1CC2=CC=C(C(=O)N2)c3ccc(cc3OC)OC |
