TO8
Summary
| Name: | 7-chloranyl-4-(dimethylamino)-1~{H}-quinazolin-2-one |
| Formula: | C10 H10 Cl N3 O |
| Formal charge: | 0 |
| Formula weight: | 223.659 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 7-chloranyl-4-(dimethylamino)-1~{H}-quinazolin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H10ClN3O/c1-14(2)9-7-4-3-6(11)5-8(7)12-10(15)13-9/h3-5H,1-2H3,(H,12,13,15) |
| InChIKey | InChI | 1.03 | DSCYGQFCBQYCTA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)C1=NC(=O)Nc2cc(Cl)ccc12 |
| SMILES | CACTVS | 3.385 | CN(C)C1=NC(=O)Nc2cc(Cl)ccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN(C)C1=NC(=O)Nc2c1ccc(c2)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN(C)C1=NC(=O)Nc2c1ccc(c2)Cl |
