EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H20N4O4S |
| Net Charge | 0 |
| Average Mass | 388.449 |
| Monoisotopic Mass | 388.12053 |
| SMILES | Cc1cc(C)c2c(c1)C(=NNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])CCC2 |
| InChI | InChI=1S/C18H20N4O4S/c1-11-8-12(2)14-4-3-5-16(15(14)9-11)20-21-17-7-6-13(27(19,25)26)10-18(17)22(23)24/h6-10,21H,3-5H2,1-2H3,(H2,19,25,26) |
| InChIKey | PMZBGUZHBSTEOQ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[2-(5,7-dimethyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinyl]-3-nitrobenzenesulfonamide (CHEBI:112828) is a tetralins (CHEBI:36786) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24238 | LINCS |