TO5
Summary
| Name: | 7-chloranyl-4-(dimethylamino)-1-pyridin-3-yl-quinazolin-2-one |
| Formula: | C15 H13 Cl N4 O |
| Formal charge: | 0 |
| Formula weight: | 300.743 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 7-chloranyl-4-(dimethylamino)-1-pyridin-3-yl-quinazolin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H13ClN4O/c1-19(2)14-12-6-5-10(16)8-13(12)20(15(21)18-14)11-4-3-7-17-9-11/h3-9H,1-2H3 |
| InChIKey | InChI | 1.03 | MOENMGQGTQAHPW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)C1=NC(=O)N(c2cccnc2)c3cc(Cl)ccc13 |
| SMILES | CACTVS | 3.385 | CN(C)C1=NC(=O)N(c2cccnc2)c3cc(Cl)ccc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN(C)C1=NC(=O)N(c2c1ccc(c2)Cl)c3cccnc3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN(C)C1=NC(=O)N(c2c1ccc(c2)Cl)c3cccnc3 |
