IBK
Summary
| Name: | N-isobutyl-2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}acetamide |
| Formula: | C14 H18 N2 O3 S |
| Formal charge: | 0 |
| Formula weight: | 294.369 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-(2-methylpropyl)-2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}acetamide |
| OpenEye OEToolkits | 1.9.2 | N-(2-methylpropyl)-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(NCC(C)C)COCc2noc(c1sccc1)c2 |
| InChI | InChI | 1.03 | InChI=1S/C14H18N2O3S/c1-10(2)7-15-14(17)9-18-8-11-6-12(19-16-11)13-4-3-5-20-13/h3-6,10H,7-9H2,1-2H3,(H,15,17) |
| InChIKey | InChI | 1.03 | UJFGIBAYRIRNOV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)CNC(=O)COCc1cc(on1)c2sccc2 |
| SMILES | CACTVS | 3.385 | CC(C)CNC(=O)COCc1cc(on1)c2sccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CC(C)CNC(=O)COCc1cc(on1)c2cccs2 |
| SMILES | OpenEye OEToolkits | 1.9.2 | CC(C)CNC(=O)COCc1cc(on1)c2cccs2 |
