EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H30N2O3S2 |
| Net Charge | 0 |
| Average Mass | 446.638 |
| Monoisotopic Mass | 446.16978 |
| SMILES | Cc1ccc(NS(=O)(=O)c2cc(C(=O)NCCSC3CCCCC3)ccc2C)cc1 |
| InChI | InChI=1S/C23H30N2O3S2/c1-17-8-12-20(13-9-17)25-30(27,28)22-16-19(11-10-18(22)2)23(26)24-14-15-29-21-6-4-3-5-7-21/h8-13,16,21,25H,3-7,14-15H2,1-2H3,(H,24,26) |
| InChIKey | XZRAPRHDIBCXOT-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[2-(cyclohexylthio)ethyl]-4-methyl-3-[(4-methylphenyl)sulfamoyl]benzamide (CHEBI:113176) is a sulfonamide (CHEBI:35358) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24587 | LINCS |