EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H22N4O3S2 |
| Net Charge | 0 |
| Average Mass | 442.566 |
| Monoisotopic Mass | 442.11333 |
| SMILES | CCCCn1c(SCc2ncc(-c3ccccc3)o2)nc2cc(S(N)(=O)=O)ccc21 |
| InChI | InChI=1S/C21H22N4O3S2/c1-2-3-11-25-18-10-9-16(30(22,26)27)12-17(18)24-21(25)29-14-20-23-13-19(28-20)15-7-5-4-6-8-15/h4-10,12-13H,2-3,11,14H2,1H3,(H2,22,26,27) |
| InChIKey | GSHRPDGNRLXSDB-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-butyl-2-[(5-phenyl-2-oxazolyl)methylthio]-5-benzimidazolesulfonamide (CHEBI:119820) is a 1,3-oxazoles (CHEBI:46812) |
| Manual Xrefs | Databases |
|---|---|
| LSM-31264 | LINCS |