GN6
Summary
| Name: | 5-(2,3-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyridin-2-amine |
| Formula: | C12 H8 Cl2 N4 |
| Formal charge: | 0 |
| Formula weight: | 279.125 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5-(2,3-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyridin-2-amine |
| OpenEye OEToolkits | 2.0.7 | 5-[2,3-bis(chloranyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n12nc(nc1cccc2c3cccc(c3Cl)Cl)N |
| InChI | InChI | 1.03 | InChI=1S/C12H8Cl2N4/c13-8-4-1-3-7(11(8)14)9-5-2-6-10-16-12(15)17-18(9)10/h1-6H,(H2,15,17) |
| InChIKey | InChI | 1.03 | JFVBFJXXXHHBSP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1nn2c(cccc2c3cccc(Cl)c3Cl)n1 |
| SMILES | CACTVS | 3.385 | Nc1nn2c(cccc2c3cccc(Cl)c3Cl)n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1)Cl)Cl)c2cccc3n2nc(n3)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1)Cl)Cl)c2cccc3n2nc(n3)N |
