EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H18N6OS |
| Net Charge | 0 |
| Average Mass | 342.428 |
| Monoisotopic Mass | 342.12628 |
| SMILES | c1ccc(-c2noc(CSc3nnnn3C3CCCCC3)n2)cc1 |
| InChI | InChI=1S/C16H18N6OS/c1-3-7-12(8-4-1)15-17-14(23-19-15)11-24-16-18-20-21-22(16)13-9-5-2-6-10-13/h1,3-4,7-8,13H,2,5-6,9-11H2 |
| InChIKey | WPENLLOICBPYIE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-[[(1-cyclohexyl-5-tetrazolyl)thio]methyl]-3-phenyl-1,2,4-oxadiazole (CHEBI:112162) is a oxadiazole (CHEBI:46685) |
| 5-[[(1-cyclohexyl-5-tetrazolyl)thio]methyl]-3-phenyl-1,2,4-oxadiazole (CHEBI:112162) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-23574 | LINCS |