IWG
Summary
| Name: | 5-[(4-chloronaphthalen-1-yl)oxy]-1,2,3-thiadiazole |
| Formula: | C12 H7 Cl N2 O S |
| Formal charge: | 0 |
| Formula weight: | 262.715 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5-[(4-chloronaphthalen-1-yl)oxy]-1,2,3-thiadiazole |
| OpenEye OEToolkits | 2.0.7 | 5-(4-chloranylnaphthalen-1-yl)oxy-1,2,3-thiadiazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc1ccc(Oc2cnns2)c2ccccc21 |
| InChI | InChI | 1.03 | InChI=1S/C12H7ClN2OS/c13-10-5-6-11(16-12-7-14-15-17-12)9-4-2-1-3-8(9)10/h1-7H |
| InChIKey | InChI | 1.03 | MXBFWTAMROYSLZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc(Oc2snnc2)c3ccccc13 |
| SMILES | CACTVS | 3.385 | Clc1ccc(Oc2snnc2)c3ccccc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(ccc2Cl)Oc3cnns3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(ccc2Cl)Oc3cnns3 |
