EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:40008 - 3-(5-{[4-(aminomethyl)piperidin-1-yl]methyl}-1H-indol-2-yl)-1H-indazole-6-carbonitrile

ChEBI IDCHEBI:40008
ChEBI Name3-(5-{[4-(aminomethyl)piperidin-1-yl]methyl}-1H-indol-2-yl)-1H-indazole-6-carbonitrile
Stars
ASCII Name3-(5-{[4-(aminomethyl)piperidin-1-yl]methyl}-1H-indol-2-yl)-1H-indazole-6-carbonitrile
Last Modified17 October 2009
DownloadsMolfile
FormulaC23H24N6
Net Charge0
Average Mass384.487
Monoisotopic Mass384.20624
SMILES[H]c1c(C#N)c([H])c2c(c(-c3c([H])c4c([H])c(C([H])([H])N5C([H])([H])C([H])([H])C([H])(C([H])([H])N([H])[H])C([H])([H])C5([H])[H])c([H])c([H])c4n3[H])nn2[H])c1[H]
InChIInChI=1S/C23H24N6/c24-12-15-5-7-29(8-6-15)14-17-2-4-20-18(9-17)11-22(26-20)23-19-3-1-16(13-25)10-21(19)27-28-23/h1-4,9-11,15,26H,5-8,12,14,24H2,(H,27,28)
InChIKeyWBKUBPBCFYCSRT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-(5-{[4-(aminomethyl)piperidin-1-yl]methyl}-1H-indol-2-yl)-1H-indazole-6-carbonitrile (CHEBI:40008) is a indazoles (CHEBI:38769)
3-(5-{[4-(aminomethyl)piperidin-1-yl]methyl}-1H-indol-2-yl)-1H-indazole-6-carbonitrile (CHEBI:40008) is a indoles (CHEBI:24828)
3-(5-{[4-(aminomethyl)piperidin-1-yl]methyl}-1H-indol-2-yl)-1H-indazole-6-carbonitrile (CHEBI:40008) is a nitrile (CHEBI:18379)
3-(5-{[4-(aminomethyl)piperidin-1-yl]methyl}-1H-indol-2-yl)-1H-indazole-6-carbonitrile (CHEBI:40008) is a piperidines (CHEBI:26151)
Synonyms  Source
3-(5-{[4-(AMINOMETHYL)PIPERIDIN-1-YL]METHYL}-1H-INDOL-2-YL)-1H-INDAZOLE-6-CARBONITRILEPDBeChem
3-(5-{[4-(aminomethyl)piperidin-1-yl]methyl}-1H-indol-2-yl)-1H-indazole-6-carbonitrilePDBeChem
Manual XrefsDatabases
422PDBeChem