EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H32N2O3S2 |
| Net Charge | 0 |
| Average Mass | 448.654 |
| Monoisotopic Mass | 448.18543 |
| SMILES | Cc1cccc(-c2nc(CS(=O)CC(=O)NCCCSC3CCCCC3)c(C)o2)c1 |
| InChI | InChI=1S/C23H32N2O3S2/c1-17-8-6-9-19(14-17)23-25-21(18(2)28-23)15-30(27)16-22(26)24-12-7-13-29-20-10-4-3-5-11-20/h6,8-9,14,20H,3-5,7,10-13,15-16H2,1-2H3,(H,24,26) |
| InChIKey | GXZOPNFPXQZSTG-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[3-(cyclohexylthio)propyl]-2-[[5-methyl-2-(3-methylphenyl)-4-oxazolyl]methylsulfinyl]acetamide (CHEBI:116438) is a 1,3-oxazoles (CHEBI:46812) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27892 | LINCS |