EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C7H13N3S |
| Net Charge | 0 |
| Average Mass | 171.269 |
| Monoisotopic Mass | 171.08302 |
| SMILES | CC1=NN(C(N)=S)C(C)(C)C1 |
| InChI | InChI=1S/C7H13N3S/c1-5-4-7(2,3)10(9-5)6(8)11/h4H2,1-3H3,(H2,8,11) |
| InChIKey | GQAFTAYUUOBTRK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3,5,5-trimethyl-4H-pyrazole-1-carbothioamide (CHEBI:107321) is a hydrazone (CHEBI:38532) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18675 | LINCS |