EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:107672 - 4-[oxo-(4-oxo-5H-thieno[3,2-c]quinolin-2-yl)methyl]-1-piperazinecarboxylic acid ethyl ester
| Formula | C19H19N3O4S |
| Net Charge | 0 |
| Average Mass | 385.445 |
| Monoisotopic Mass | 385.10963 |
| SMILES | CCOC(=O)N1CCN(C(=O)c2cc3c(=O)nc4ccccc4c3s2)CC1 |
| InChI | InChI=1S/C19H19N3O4S/c1-2-26-19(25)22-9-7-21(8-10-22)18(24)15-11-13-16(27-15)12-5-3-4-6-14(12)20-17(13)23/h3-6,11H,2,7-10H2,1H3,(H,20,23) |
| InChIKey | MGPLWXMMDWAEOO-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[oxo-(4-oxo-5H-thieno[3,2-c]quinolin-2-yl)methyl]-1-piperazinecarboxylic acid ethyl ester (CHEBI:107672) is a organic heterotricyclic compound (CHEBI:26979) |
| 4-[oxo-(4-oxo-5H-thieno[3,2-c]quinolin-2-yl)methyl]-1-piperazinecarboxylic acid ethyl ester (CHEBI:107672) is a organonitrogen heterocyclic compound (CHEBI:38101) |
| 4-[oxo-(4-oxo-5H-thieno[3,2-c]quinolin-2-yl)methyl]-1-piperazinecarboxylic acid ethyl ester (CHEBI:107672) is a organosulfur heterocyclic compound (CHEBI:38106) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19051 | LINCS |