OPW
Summary
| Name: | ~{N}-[5-(5-methoxy-1,3-benzothiazol-2-yl)pyridin-3-yl]ethanamide |
| Formula: | C15 H13 N3 O2 S |
| Formal charge: | 0 |
| Formula weight: | 299.348 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-[5-(5-methoxy-1,3-benzothiazol-2-yl)pyridin-3-yl]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H13N3O2S/c1-9(19)17-11-5-10(7-16-8-11)15-18-13-6-12(20-2)3-4-14(13)21-15/h3-8H,1-2H3,(H,17,19) |
| InChIKey | InChI | 1.03 | JLUXIHDOQQZMIZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc2sc(nc2c1)c3cncc(NC(C)=O)c3 |
| SMILES | CACTVS | 3.385 | COc1ccc2sc(nc2c1)c3cncc(NC(C)=O)c3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1cc(cnc1)c2nc3cc(ccc3s2)OC |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1cc(cnc1)c2nc3cc(ccc3s2)OC |
