EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:116766 - N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-8-methyl-4-oxo-2-thieno[3,2-c][1]benzopyrancarboxamide

ChEBI IDCHEBI:116766
ChEBI NameN-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-8-methyl-4-oxo-2-thieno[3,2-c][1]benzopyrancarboxamide
Stars
DownloadsMolfile
FormulaC24H22N2O3S
Net Charge0
Average Mass418.518
Monoisotopic Mass418.13511
SMILESCc1ccc2oc(=O)c3cc(C(=O)NCCN4CCc5ccccc5C4)sc3c2c1
InChIInChI=1S/C24H22N2O3S/c1-15-6-7-20-18(12-15)22-19(24(28)29-20)13-21(30-22)23(27)25-9-11-26-10-8-16-4-2-3-5-17(16)14-26/h2-7,12-13H,8-11,14H2,1H3,(H,25,27)
InChIKeyPWEOZCBEVAXSOH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-8-methyl-4-oxo-2-thieno[3,2-c][1]benzopyrancarboxamide (CHEBI:116766) is a coumarins (CHEBI:23403)
Manual XrefsDatabases
LSM-28218LINCS