EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H12N4S |
| Net Charge | 0 |
| Average Mass | 256.334 |
| Monoisotopic Mass | 256.07827 |
| SMILES | C=CCSc1nnc2c(n1)nc1c(C)cccc12 |
| InChI | InChI=1S/C13H12N4S/c1-3-7-18-13-15-12-11(16-17-13)9-6-4-5-8(2)10(9)14-12/h3-6H,1,7H2,2H3,(H,14,15,17) |
| InChIKey | DSNPRSDQOUSZDD-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-methyl-3-(prop-2-enylthio)-5H-[1,2,4]triazino[5,6-b]indole (CHEBI:116288) is a triazinoindole (CHEBI:142677) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27743 | LINCS |