9AW
Summary
| Name: | 2-(4-pyridin-2-ylphenyl)-3~{H}-quinazolin-4-one |
| Formula: | C19 H13 N3 O |
| Formal charge: | 0 |
| Formula weight: | 299.326 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 2-(4-pyridin-2-ylphenyl)-3~{H}-quinazolin-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C19H13N3O/c23-19-15-5-1-2-7-17(15)21-18(22-19)14-10-8-13(9-11-14)16-6-3-4-12-20-16/h1-12H,(H,21,22,23) |
| InChIKey | InChI | 1.03 | YFPZUOWERSWGPK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1NC(=Nc2ccccc12)c3ccc(cc3)c4ccccn4 |
| SMILES | CACTVS | 3.385 | O=C1NC(=Nc2ccccc12)c3ccc(cc3)c4ccccn4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)C(=O)NC(=N2)c3ccc(cc3)c4ccccn4 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)C(=O)NC(=N2)c3ccc(cc3)c4ccccn4 |
