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CHEBI:131351 - CGS 15943

ChEBI IDCHEBI:131351
ChEBI NameCGS 15943
Stars
DefinitionA member of the class of triazoloquinazolines that is [1,2,4]triazolo[1,5-c]quinazoline substited at positions 2, 5 and 9 by furan-2-yl, amino and chloro groups respectively. A potent antagonist at adenosine A1 and adenosine A2A receptors.
Last Modified29 February 2016
SubmitterSteve
DownloadsMolfile
FormulaC13H8ClN5O
Net Charge0
Average Mass285.694
Monoisotopic Mass285.04174
SMILESNc1nc2ccc(Cl)cc2c2nc(-c3ccco3)nn12
InChIInChI=1S/C13H8ClN5O/c14-7-3-4-9-8(6-7)12-17-11(10-2-1-5-20-10)18-19(12)13(15)16-9/h1-6H,(H2,15,16)
InChIKeyMSJODEOZODDVGW-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
adenosine A1 receptor antagonist  An antagonist at the A1 receptor.
adenosine A2A receptor antagonist  An antagonist at the A2A receptor.
Applications:
central nervous system stimulant  Any drug that enhances the activity of the central nervous system.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
CGS 15943 (CHEBI:131351) has role adenosine A1 receptor antagonist (CHEBI:63957)
CGS 15943 (CHEBI:131351) has role adenosine A2A receptor antagonist (CHEBI:53121)
CGS 15943 (CHEBI:131351) has role antineoplastic agent (CHEBI:35610)
CGS 15943 (CHEBI:131351) has role central nervous system stimulant (CHEBI:35337)
CGS 15943 (CHEBI:131351) is a aromatic amine (CHEBI:33860)
CGS 15943 (CHEBI:131351) is a biaryl (CHEBI:64459)
CGS 15943 (CHEBI:131351) is a furans (CHEBI:24129)
CGS 15943 (CHEBI:131351) is a organochlorine compound (CHEBI:36683)
CGS 15943 (CHEBI:131351) is a primary amino compound (CHEBI:50994)
CGS 15943 (CHEBI:131351) is a triazoloquinazoline (CHEBI:131355)
IUPAC Name 
9-chloro-2-(furan-2-yl)[1,2,4]triazolo[1,5-c]quinazolin-5-amine
Synonyms  Source
CGS 15943AChemIDplus
9-Chloro-2-(2-furyl)-(1,2,4)triazolo(1,5-c)quinazolin-5-imineChemIDplus
CGS15943ChEBI
CGS-15943ChEBI
Manual XrefsDatabases
CGS-15943Wikipedia
Registry NumbersSources
Reaxys:4237267Reaxys
CAS:104615-18-1ChemIDplus
Citations