EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H18N2O4S2 |
| Net Charge | 0 |
| Average Mass | 366.464 |
| Monoisotopic Mass | 366.07080 |
| SMILES | COc1ccc(C2=NN(S(C)(=O)=O)C(c3cccs3)C2)cc1OC |
| InChI | InChI=1S/C16H18N2O4S2/c1-21-14-7-6-11(9-15(14)22-2)12-10-13(16-5-4-8-23-16)18(17-12)24(3,19)20/h4-9,13H,10H2,1-3H3 |
| InChIKey | AYJHACKOWMKGLK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-(3,4-dimethoxyphenyl)-2-methylsulfonyl-3-thiophen-2-yl-3,4-dihydropyrazole (CHEBI:112744) is a dimethoxybenzene (CHEBI:51681) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24154 | LINCS |