EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:117126 - 1-(4-chlorophenyl)-5-[[4-(4-morpholinyl)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

ChEBI IDCHEBI:117126
ChEBI Name1-(4-chlorophenyl)-5-[[4-(4-morpholinyl)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Stars
DownloadsMolfile
FormulaC21H19ClN4O3S
Net Charge0
Average Mass442.928
Monoisotopic Mass442.08664
SMILESO=C1NC(=S)N(c2ccc(Cl)cc2)C(=O)C1=CNc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C21H19ClN4O3S/c22-14-1-5-17(6-2-14)26-20(28)18(19(27)24-21(26)30)13-23-15-3-7-16(8-4-15)25-9-11-29-12-10-25/h1-8,13,23H,9-12H2,(H,24,27,30)
InChIKeyDSTCJHCSWPJKAU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(4-chlorophenyl)-5-[[4-(4-morpholinyl)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione (CHEBI:117126) is a morpholines (CHEBI:38785)
Manual XrefsDatabases
LSM-28575LINCS