CHEBI:47148 - 4-({6-amino-5-bromo-2-[(4-cyanophenyl)amino]pyrimidin-4-yl}oxy)-3,5-dimethylbenzonitrile

ChEBI IDCHEBI:47148
ChEBI Name4-({6-amino-5-bromo-2-[(4-cyanophenyl)amino]pyrimidin-4-yl}oxy)-3,5-dimethylbenzonitrile
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC20H15BrN6O
Net Charge0
Average Mass435.285
Monoisotopic Mass434.04907
SMILESCc1cc(C#N)cc(C)c1Oc1nc(Nc2ccc(C#N)cc2)nc(N)c1Br
InChIInChI=1S/C20H15BrN6O/c1-11-7-14(10-23)8-12(2)17(11)28-19-16(21)18(24)26-20(27-19)25-15-5-3-13(9-22)4-6-15/h3-8H,1-2H3,(H3,24,25,26,27)
InChIKeyPYGWGZALEOIKDF-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-({6-amino-5-bromo-2-[(4-cyanophenyl)amino]pyrimidin-4-yl}oxy)-3,5-dimethylbenzonitrile (CHEBI:47148) is a aminopyrimidine (CHEBI:38338)
4-({6-amino-5-bromo-2-[(4-cyanophenyl)amino]pyrimidin-4-yl}oxy)-3,5-dimethylbenzonitrile (CHEBI:47148) is a nitrile (CHEBI:18379)
4-({6-amino-5-bromo-2-[(4-cyanophenyl)amino]pyrimidin-4-yl}oxy)-3,5-dimethylbenzonitrile (CHEBI:47148) is a organobromine compound (CHEBI:37141)
Synonyms  Source
4-({6-amino-5-bromo-2-[(4-cyanophenyl)amino]pyrimidin-4-yl}oxy)-3,5-dimethylbenzonitrilePDBeChem
4-({6-AMINO-5-BROMO-2-[(4-CYANOPHENYL)AMINO]PYRIMIDIN-4-YL}OXY)-3,5-DIMETHYLBENZONITRILEPDBeChem
R-165335DrugCentral
TMC-125DrugCentral
etravirinDrugCentral
intelenceDrugCentral
Manual XrefsDatabases
65BPDBeChem
1115DrugCentral
Registry NumbersSources
CAS:269055-15-4DrugCentral