EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H13NO2S |
| Net Charge | 0 |
| Average Mass | 247.319 |
| Monoisotopic Mass | 247.06670 |
| SMILES | CS(=O)(=O)Nc1ccc2c3c(cccc13)CC2 |
| InChI | InChI=1S/C13H13NO2S/c1-17(15,16)14-12-8-7-10-6-5-9-3-2-4-11(12)13(9)10/h2-4,7-8,14H,5-6H2,1H3 |
| InChIKey | NPGRAIIBMVPZHD-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(1,2-dihydroacenaphthylen-5-yl)methanesulfonamide (CHEBI:105190) is a naphthalenes (CHEBI:25477) |
| Manual Xrefs | Databases |
|---|---|
| LSM-16553 | LINCS |