EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C13H11BrClN3O2S |
| Net Charge | 0 |
| Average Mass | 388.674 |
| Monoisotopic Mass | 386.94439 |
| SMILES | O=C(NNC(=S)NCc1ccc(Cl)cc1)c1ccc(Br)o1 |
| InChI | InChI=1S/C13H11BrClN3O2S/c14-11-6-5-10(20-11)12(19)17-18-13(21)16-7-8-1-3-9(15)4-2-8/h1-6H,7H2,(H,17,19)(H2,16,18,21) |
| InChIKey | LVWAWTKAIJTWBK-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[[(5-bromo-2-furanyl)-oxomethyl]amino]-3-[(4-chlorophenyl)methyl]thiourea (CHEBI:109364) is a furoic acid (CHEBI:36055) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20762 | LINCS |