EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H15BrN4S2 |
| Net Charge | 0 |
| Average Mass | 371.329 |
| Monoisotopic Mass | 369.99215 |
| SMILES | S=c1nnc(C2CCCCC2)n1N=Cc1ccc(Br)s1 |
| InChI | InChI=1S/C13H15BrN4S2/c14-11-7-6-10(20-11)8-15-18-12(16-17-13(18)19)9-4-2-1-3-5-9/h6-9H,1-5H2,(H,17,19) |
| InChIKey | YNCSZKXHXVCFKK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[(5-bromo-2-thiophenyl)methylideneamino]-3-cyclohexyl-1H-1,2,4-triazole-5-thione (CHEBI:116868) is a thiophenes (CHEBI:26961) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28319 | LINCS |