A1ENQ
Summary
| Name: | 4-[1-(pyridin-4-ylmethyl)benzimidazol-2-yl]-1,2,5-oxadiazol-3-amine |
| Synonyms: | Kcnk13-IN-1 |
| Formula: | C15 H12 N6 O |
| Formal charge: | 0 |
| Formula weight: | 292.295 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-[1-(pyridin-4-ylmethyl)benzimidazol-2-yl]-1,2,5-oxadiazol-3-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C15H12N6O/c16-14-13(19-22-20-14)15-18-11-3-1-2-4-12(11)21(15)9-10-5-7-17-8-6-10/h1-8H,9H2,(H2,16,20) |
| InChIKey | InChI | 1.06 | LXADAVBNVFYEBW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1nonc1c2nc3ccccc3n2Cc4ccncc4 |
| SMILES | CACTVS | 3.385 | Nc1nonc1c2nc3ccccc3n2Cc4ccncc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)nc(n2Cc3ccncc3)c4c(non4)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)nc(n2Cc3ccncc3)c4c(non4)N |
