EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H20N4O4S |
| Net Charge | 0 |
| Average Mass | 436.493 |
| Monoisotopic Mass | 436.12053 |
| SMILES | O=C(NC(=S)Nc1ccccc1N1CCCC1)c1ccc(-c2cccc([N+](=O)[O-])c2)o1 |
| InChI | InChI=1S/C22H20N4O4S/c27-21(20-11-10-19(30-20)15-6-5-7-16(14-15)26(28)29)24-22(31)23-17-8-1-2-9-18(17)25-12-3-4-13-25/h1-2,5-11,14H,3-4,12-13H2,(H2,23,24,27,31) |
| InChIKey | AWXTVMYBDNOCOU-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-(3-nitrophenyl)-N-[[2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]-2-furancarboxamide (CHEBI:109680) is a thioureas (CHEBI:51276) |
| Manual Xrefs | Databases |
|---|---|
| LSM-21108 | LINCS |