EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:107195 - 5-(4-chlorophenyl)-3-[(5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-4-thieno[2,3-d]pyrimidinone
| Formula | C19H11ClN4O4S |
| Net Charge | 0 |
| Average Mass | 426.841 |
| Monoisotopic Mass | 426.01895 |
| SMILES | O=C1C(=CNn2cnc3scc(-c4ccc(Cl)cc4)c3c2=O)C=CC=C1[N+](=O)[O-] |
| InChI | InChI=1S/C19H11ClN4O4S/c20-13-6-4-11(5-7-13)14-9-29-18-16(14)19(26)23(10-21-18)22-8-12-2-1-3-15(17(12)25)24(27)28/h1-10,22H |
| InChIKey | JJYROOYUXPUWFG-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-(4-chlorophenyl)-3-[(5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-4-thieno[2,3-d]pyrimidinone (CHEBI:107195) is a organic heterobicyclic compound (CHEBI:27171) |
| 5-(4-chlorophenyl)-3-[(5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-4-thieno[2,3-d]pyrimidinone (CHEBI:107195) is a organonitrogen heterocyclic compound (CHEBI:38101) |
| 5-(4-chlorophenyl)-3-[(5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-4-thieno[2,3-d]pyrimidinone (CHEBI:107195) is a organosulfur heterocyclic compound (CHEBI:38106) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18549 | LINCS |