OLU
Summary
| Name: | 2-(6-HYDROXY-1,3-BENZOTHIAZOL-2-YL)-1,3-THIAZOL-4(5H)-ONE |
| Synonyms: | OXYLUCIFERIN |
| Formula: | C10 H6 N2 O2 S2 |
| Formal charge: | 0 |
| Formula weight: | 250.297 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-(6-hydroxy-1,3-benzothiazol-2-yl)-1,3-thiazol-4(5H)-one |
| OpenEye OEToolkits | 1.5.0 | 2-(6-hydroxy-1,3-benzothiazol-2-yl)-1,3-thiazol-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1N=C(SC1)c2sc3c(n2)ccc(O)c3 |
| SMILES_CANONICAL | CACTVS | 3.341 | Oc1ccc2nc(sc2c1)C3=NC(=O)CS3 |
| SMILES | CACTVS | 3.341 | Oc1ccc2nc(sc2c1)C3=NC(=O)CS3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1O)sc(n2)C3=NC(=O)CS3 |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1O)sc(n2)C3=NC(=O)CS3 |
| InChI | InChI | 1.03 | InChI=1S/C10H6N2O2S2/c13-5-1-2-6-7(3-5)16-10(11-6)9-12-8(14)4-15-9/h1-3,13H,4H2 |
| InChIKey | InChI | 1.03 | JJVOROULKOMTKG-UHFFFAOYSA-N |
