LT7
Summary
| Name: | ~{N}-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]propan-2-amine |
| Formula: | C13 H17 N3 O |
| Formal charge: | 0 |
| Formula weight: | 231.294 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | ~{N}-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]propan-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H17N3O/c1-9(2)14-8-12-15-13(16-17-12)11-6-4-10(3)5-7-11/h4-7,9,14H,8H2,1-3H3 |
| InChIKey | InChI | 1.03 | XQOSNFJUNZPHAW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)NCc1onc(n1)c2ccc(C)cc2 |
| SMILES | CACTVS | 3.385 | CC(C)NCc1onc(n1)c2ccc(C)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1ccc(cc1)c2nc(on2)CNC(C)C |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1ccc(cc1)c2nc(on2)CNC(C)C |
