EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C17H18N4O2S |
| Net Charge | 0 |
| Average Mass | 342.424 |
| Monoisotopic Mass | 342.11505 |
| SMILES | COc1ccc(CCn2c(-c3ccncc3)nnc2=S)cc1OC |
| InChI | InChI=1S/C17H18N4O2S/c1-22-14-4-3-12(11-15(14)23-2)7-10-21-16(19-20-17(21)24)13-5-8-18-9-6-13/h3-6,8-9,11H,7,10H2,1-2H3,(H,20,24) |
| InChIKey | ZIZZNZDGXGANHZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione (CHEBI:114526) is a triazoles (CHEBI:35727) |
| Manual Xrefs | Databases |
|---|---|
| LSM-25987 | LINCS |