A1FDL
Summary
| Name: | 6-bromanyl-~{N}-[2-(5-methylimidazol-1-yl)ethyl]quinazolin-2-amine |
| Formula: | C14 H14 Br N5 |
| Formal charge: | 0 |
| Formula weight: | 332.198 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6-bromanyl-~{N}-[2-(5-methylimidazol-1-yl)ethyl]quinazolin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C14H14BrN5/c1-10-7-16-9-20(10)5-4-17-14-18-8-11-6-12(15)2-3-13(11)19-14/h2-3,6-9H,4-5H2,1H3,(H,17,18,19) |
| InChIKey | InChI | 1.06 | XFXWJUOGBJWWDK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cncn1CCNc2ncc3cc(Br)ccc3n2 |
| SMILES | CACTVS | 3.385 | Cc1cncn1CCNc2ncc3cc(Br)ccc3n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cncn1CCNc2ncc3cc(ccc3n2)Br |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cncn1CCNc2ncc3cc(ccc3n2)Br |
