U2T
Summary
| Name: | 3-(4-~{tert}-butylphenyl)-1,2,4-oxadiazole-5-carbohydrazide |
| Formula: | C13 H16 N4 O2 |
| Formal charge: | 0 |
| Formula weight: | 260.292 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-(4-~{tert}-butylphenyl)-1,2,4-oxadiazole-5-carbohydrazide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H16N4O2/c1-13(2,3)9-6-4-8(5-7-9)10-15-12(19-17-10)11(18)16-14/h4-7H,14H2,1-3H3,(H,16,18) |
| InChIKey | InChI | 1.03 | VCNKWJYUMPASMU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)(C)c1ccc(cc1)c2noc(n2)C(=O)NN |
| SMILES | CACTVS | 3.385 | CC(C)(C)c1ccc(cc1)c2noc(n2)C(=O)NN |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)(C)c1ccc(cc1)c2nc(on2)C(=O)NN |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)(C)c1ccc(cc1)c2nc(on2)C(=O)NN |
