EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H21ClN4O2S |
| Net Charge | 0 |
| Average Mass | 404.923 |
| Monoisotopic Mass | 404.10737 |
| SMILES | CCn1c(N2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)nc2ccccc21 |
| InChI | InChI=1S/C19H21ClN4O2S/c1-2-24-18-6-4-3-5-17(18)21-19(24)22-11-13-23(14-12-22)27(25,26)16-9-7-15(20)8-10-16/h3-10H,2,11-14H2,1H3 |
| InChIKey | WAWROLBZXUSKFC-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-1-ethylbenzimidazole (CHEBI:112167) is a N-arylpiperazine (CHEBI:46848) |
| Manual Xrefs | Databases |
|---|---|
| LSM-23579 | LINCS |