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CHEBI:140953 - 6-chloro-5-methyl-N-[6-(2-methylpyridin-3-yl)oxypyridin-3-yl]-2,3-dihydroindole-1-carboxamide;dihydrochloride
| Formula | C21H19ClN4O2.2HCl |
| Net Charge | 0 |
| Average Mass | 467.784 |
| Monoisotopic Mass | 466.07301 |
| SMILES | [H]Cl.[H]Cl.[H]c1nc(Oc2cccnc2C)ccc1NC(=O)N1CCc2cc(C)c(Cl)cc21 |
| InChI | InChI=1S/C21H19ClN4O2.2ClH/c1-13-10-15-7-9-26(18(15)11-17(13)22)21(27)25-16-5-6-20(24-12-16)28-19-4-3-8-23-14(19)2;;/h3-6,8,10-12H,7,9H2,1-2H3,(H,25,27);2*1H |
| InChIKey | GCMNSEILNIPNSX-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | environmental contaminant Any minor or unwanted substance introduced into the environment that can have undesired effects. |
| Biological Role: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| Application: | receptor modulator A drug that acts as an antagonist, agonist, reverse agonist, or in some other fashion when interacting with cellular receptors. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-chloro-5-methyl-N-[6-(2-methylpyridin-3-yl)oxypyridin-3-yl]-2,3-dihydroindole-1-carboxamide;dihydrochloride (CHEBI:140953) has role receptor modulator (CHEBI:90710) |
| 6-chloro-5-methyl-N-[6-(2-methylpyridin-3-yl)oxypyridin-3-yl]-2,3-dihydroindole-1-carboxamide;dihydrochloride (CHEBI:140953) is a indole alkaloid (CHEBI:38958) |
| 6-chloro-5-methyl-N-[6-(2-methylpyridin-3-yl)oxypyridin-3-yl]-2,3-dihydroindole-1-carboxamide;dihydrochloride (CHEBI:140953) is a organic molecular entity (CHEBI:50860) |
| 6-chloro-5-methyl-N-[6-(2-methylpyridin-3-yl)oxypyridin-3-yl]-2,3-dihydroindole-1-carboxamide;dihydrochloride (CHEBI:140953) is a pyridine (CHEBI:16227) |
| Synonyms | Source |
|---|---|
| SB 242084 dihydrochloride | SUBMITTER |
| 6-Chloro-5-methyl-1-[[2-(2-methylpyrid-3-yloxy)pyrid-5-yl]carbamoyl]indoline dihydrochloride hydrate | SUBMITTER |
| Manual Xrefs | Databases |
|---|---|
| 16219981 | PubChem Compound |
| Registry Numbers | Sources |
|---|---|
| CAS:181632-25-7 | SUBMITTER |