QRN
Summary
| Name: | 5-[2-(1,3-benzothiazol-2-yl)ethyl]-2-methoxy-phenol |
| Formula: | C16 H15 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 285.361 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-[2-(1,3-benzothiazol-2-yl)ethyl]-2-methoxy-phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H15NO2S/c1-19-14-8-6-11(10-13(14)18)7-9-16-17-12-4-2-3-5-15(12)20-16/h2-6,8,10,18H,7,9H2,1H3 |
| InChIKey | InChI | 1.03 | QNHPMOUOOZOFMX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(CCc2sc3ccccc3n2)cc1O |
| SMILES | CACTVS | 3.385 | COc1ccc(CCc2sc3ccccc3n2)cc1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1O)CCc2nc3ccccc3s2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1O)CCc2nc3ccccc3s2 |
