EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:43650 - 1-{4-[4-amino-6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-5-yl]phenyl}-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea

ChEBI IDCHEBI:43650
ChEBI Name1-{4-[4-amino-6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-5-yl]phenyl}-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea
Stars
ASCII Name1-{4-[4-amino-6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-5-yl]phenyl}-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea
Last Modified17 October 2009
DownloadsMolfile
FormulaC27H19F4N5O3
Net Charge0
Average Mass537.473
Monoisotopic Mass537.14240
SMILES[H]c1nc(N([H])[H])c2c(-c3c([H])c([H])c(N([H])C(=O)N([H])c4c([H])c(C(F)(F)F)c([H])c([H])c4F)c([H])c3[H])c(-c3c([H])c([H])c(OC([H])([H])[H])c([H])c3[H])oc2n1
InChIInChI=1S/C27H19F4N5O3/c1-38-18-9-4-15(5-10-18)23-21(22-24(32)33-13-34-25(22)39-23)14-2-7-17(8-3-14)35-26(37)36-20-12-16(27(29,30)31)6-11-19(20)28/h2-13H,1H3,(H2,32,33,34)(H2,35,36,37)
InChIKeyFGZIONRFHVNRJB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-{4-[4-amino-6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-5-yl]phenyl}-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea (CHEBI:43650) is a furopyrimidine (CHEBI:46910)
1-{4-[4-amino-6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-5-yl]phenyl}-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea (CHEBI:43650) is a organofluorine compound (CHEBI:37143)
1-{4-[4-amino-6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-5-yl]phenyl}-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea (CHEBI:43650) is a ureas (CHEBI:47857)
Synonyms  Source
N-{4-[4-AMINO-6-(4-METHOXYPHENYL)FURO[2,3-D]PYRIMIDIN-5-YL]PHENYL}-N'-[2-FLUORO-5-(TRIFLUOROMETHYL)PHENYL]UREAPDBeChem
1-{4-[4-amino-6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-5-yl]phenyl}-3-[2-fluoro-5-(trifluoromethyl)phenyl]ureaPDBeChem
Manual XrefsDatabases
LIFPDBeChem