EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:105217 - 7-methyl-2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-3-quinolinecarbonitrile

ChEBI IDCHEBI:105217
ChEBI Name7-methyl-2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-3-quinolinecarbonitrile
Stars
DownloadsMolfile
FormulaC23H24N4O2S
Net Charge0
Average Mass420.538
Monoisotopic Mass420.16200
SMILESCc1ccc(S(=O)(=O)N2CCCN(c3nc4cc(C)ccc4cc3C#N)CC2)cc1
InChIInChI=1S/C23H24N4O2S/c1-17-5-8-21(9-6-17)30(28,29)27-11-3-10-26(12-13-27)23-20(16-24)15-19-7-4-18(2)14-22(19)25-23/h4-9,14-15H,3,10-13H2,1-2H3
InChIKeyADZSGAYQELWUNZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
7-methyl-2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-3-quinolinecarbonitrile (CHEBI:105217) is a sulfonamide (CHEBI:35358)
Manual XrefsDatabases
LSM-16580LINCS