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CHEBI:156469 - BI00048423

ChEBI IDCHEBI:156469
ChEBI NameBI00048423
Stars
DefinitionAn organic heterotricyclic compound that is 4,5-dihydro-1H-[1,3]thiazolo[4,5-g]indazole which is substituted at positions 1, 3 and 7 by 2-chlorophenyl, pyridin-3-yl, and [(1H-imidazol-2-ylmethyl)carbamoyl]amino groups, respectively.
Last Modified9 September 2020
Submitteralison.axtman
DownloadsMolfile
FormulaC24H19ClN8OS
Net Charge0
Average Mass502.991
Monoisotopic Mass502.10911
SMILESO=C(NCc1nccn1)Nc1nc2c(s1)-c1c(c(-c3cccnc3)nn1-c1ccccc1Cl)CC2
InChIInChI=1S/C24H19ClN8OS/c25-16-5-1-2-6-18(16)33-21-15(20(32-33)14-4-3-9-26-12-14)7-8-17-22(21)35-24(30-17)31-23(34)29-13-19-27-10-11-28-19/h1-6,9-12H,7-8,13H2,(H,27,28)(H2,29,30,31,34)
InChIKeyJXKHIJZYDXHNSW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
BI00048423 (CHEBI:156469) is a imidazoles (CHEBI:24780)
BI00048423 (CHEBI:156469) is a monochlorobenzenes (CHEBI:83403)
BI00048423 (CHEBI:156469) is a organic heterotricyclic compound (CHEBI:26979)
BI00048423 (CHEBI:156469) is a pyridines (CHEBI:26421)
BI00048423 (CHEBI:156469) is a ureas (CHEBI:47857)
IUPAC Name 
1-[1-(2-chlorophenyl)-3-(pyridin-3-yl)-4,5-dihydro-1H-[1,3]thiazolo[4,5-g]indazol-7-yl]-3-(1H-imidazol-2-ylmethyl)urea