EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:92816 - N-(1,3-benzodioxol-5-ylmethyl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-quinazolinamine

ChEBI IDCHEBI:92816
ChEBI NameN-(1,3-benzodioxol-5-ylmethyl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-quinazolinamine
Stars
DownloadsMolfile
FormulaC24H19N3O4
Net Charge0
Average Mass413.433
Monoisotopic Mass413.13756
SMILESc1nc(NCc2ccc3c(c2)OCO3)c2cc(-c3ccc4c(c3)OCCO4)ccc2n1
InChIInChI=1S/C24H19N3O4/c1-5-21-22(31-14-30-21)9-15(1)12-25-24-18-10-16(2-4-19(18)26-13-27-24)17-3-6-20-23(11-17)29-8-7-28-20/h1-6,9-11,13H,7-8,12,14H2,(H,25,26,27)
InChIKeyJETBHVUMRVCOME-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(1,3-benzodioxol-5-ylmethyl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-quinazolinamine (CHEBI:92816) is a quinazolines (CHEBI:38530)
Manual XrefsDatabases
LSM-3030LINCS