EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:43370 - 2-[4-(N-(3-DIMETHYLAMINOPROPYL)SULPHAMOYL)ANILINO]-

Default Structure
ChEBI IDCHEBI:43370
ChEBI Name2-[4-(N-(3-DIMETHYLAMINOPROPYL)SULPHAMOYL)ANILINO]-
Stars
Last Modified2 December 2009
DownloadsMolfile
FormulaC21H24N8O2S
Net Charge0
Average Mass452.544
Monoisotopic Mass452.17429
SMILES[H]c1nc(N([H])c2c([H])c([H])c(S(=O)(=O)N([H])C([H])([H])C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])[H])c([H])c2[H])nc(-c2c([H])nc3c([H])c([H])c([H])nn23)c1[H]
InChIInChI=1S/C21H24N8O2S/c1-28(2)14-4-12-25-32(30,31)17-8-6-16(7-9-17)26-21-22-13-10-18(27-21)19-15-23-20-5-3-11-24-29(19)20/h3,5-11,13,15,25H,4,12,14H2,1-2H3,(H,22,26,27)
InChIKeyBBZUBCUIVIEBCP-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[4-(N-(3-DIMETHYLAMINOPROPYL)SULPHAMOYL)ANILINO]- (CHEBI:43370) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2-[4-(N-(3-DIMETHYLAMINOPROPYL)SULPHAMOYL)ANILINO]-PDBeChem
N-[3-(dimethylamino)propyl]-4-[(4-imidazo[1,2-b]pyridazin-3-ylpyrimidin-2-yl)amino]benzenesulfonamidePDBeChem
Manual XrefsDatabases
I1PPDBeChem