EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:105607 - 2-[5-[(3-ethoxy-4-hydroxy-5-nitrophenyl)methylidene]-2,4-dioxo-3-thiazolidinyl]-N-(2-fluorophenyl)acetamide

ChEBI IDCHEBI:105607
ChEBI Name2-[5-[(3-ethoxy-4-hydroxy-5-nitrophenyl)methylidene]-2,4-dioxo-3-thiazolidinyl]-N-(2-fluorophenyl)acetamide
Stars
DownloadsMolfile
FormulaC20H16FN3O7S
Net Charge0
Average Mass461.427
Monoisotopic Mass461.06930
SMILESCCOc1cc(C=C2SC(=O)N(CC(=O)Nc3ccccc3F)C2=O)cc([N+](=O)[O-])c1O
InChIInChI=1S/C20H16FN3O7S/c1-2-31-15-8-11(7-14(18(15)26)24(29)30)9-16-19(27)23(20(28)32-16)10-17(25)22-13-6-4-3-5-12(13)21/h3-9,26H,2,10H2,1H3,(H,22,25)
InChIKeyKYPHIVXJAXXJJL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[5-[(3-ethoxy-4-hydroxy-5-nitrophenyl)methylidene]-2,4-dioxo-3-thiazolidinyl]-N-(2-fluorophenyl)acetamide (CHEBI:105607) is a C-nitro compound (CHEBI:35716)
2-[5-[(3-ethoxy-4-hydroxy-5-nitrophenyl)methylidene]-2,4-dioxo-3-thiazolidinyl]-N-(2-fluorophenyl)acetamide (CHEBI:105607) is a aromatic ether (CHEBI:35618)
Manual XrefsDatabases
LSM-16970LINCS