EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C8H4N2S2 |
| Net Charge | 0 |
| Average Mass | 192.268 |
| Monoisotopic Mass | 191.98159 |
| SMILES | S=C=Nc1ccc(N=C=S)cc1 |
| InChI | InChI=1S/C8H4N2S2/c11-5-9-7-1-2-8(4-3-7)10-6-12/h1-4H |
| InChIKey | OMWQUXGVXQELIX-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| bitoscanate (CHEBI:134845) is a benzenes (CHEBI:22712) |
| Synonyms | Source |
|---|---|
| bitoscanat | DrugCentral |
| p-Phenylene bisisothiocyanate | DrugCentral |
| 1,4-Diisothiocyanatobenzene | DrugCentral |
| Manual Xrefs | Databases |
|---|---|
| 3033 | DrugCentral |
| Registry Numbers | Sources |
|---|---|
| CAS:4044-65-9 | DrugCentral |