9CQ
Summary
| Name: | 2-[4-(2-AMINOQUINAZOLIN-4-YL)PHENYL]-N,N-DIMETHYL-ACETAMIDE |
| Formula: | C18 H18 N4 O |
| Formal charge: | 0 |
| Formula weight: | 306.362 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.7.6 | 2-[4-(2-azanylquinazolin-4-yl)phenyl]-N,N-dimethyl-ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C18H18N4O/c1-22(2)16(23)11-12-7-9-13(10-8-12)17-14-5-3-4-6-15(14)20-18(19)21-17/h3-10H,11H2,1-2H3,(H2,19,20,21) |
| InChIKey | InChI | 1.03 | IYSIGMIQNYJRNC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)C(=O)Cc1ccc(cc1)c2nc(N)nc3ccccc23 |
| SMILES | CACTVS | 3.385 | CN(C)C(=O)Cc1ccc(cc1)c2nc(N)nc3ccccc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CN(C)C(=O)Cc1ccc(cc1)c2c3ccccc3nc(n2)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | CN(C)C(=O)Cc1ccc(cc1)c2c3ccccc3nc(n2)N |
