UX2
Summary
| Name: | 9-chloranyl-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine |
| Formula: | C13 H8 Cl N5 O |
| Formal charge: | 0 |
| Formula weight: | 285.689 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 9-chloranyl-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H8ClN5O/c14-7-3-4-9-8(6-7)12-17-11(10-2-1-5-20-10)18-19(12)13(15)16-9/h1-6H,(H2,15,16) |
| InChIKey | InChI | 1.03 | MSJODEOZODDVGW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1nc2ccc(Cl)cc2c3nc(nn13)c4occc4 |
| SMILES | CACTVS | 3.385 | Nc1nc2ccc(Cl)cc2c3nc(nn13)c4occc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(oc1)c2nc3c4cc(ccc4nc(n3n2)N)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(oc1)c2nc3c4cc(ccc4nc(n3n2)N)Cl |
