EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:105835 - 4-(3,4-dimethoxyphenyl)-2-(1-piperidinyl)-6-(trifluoromethyl)pyrimidine

ChEBI IDCHEBI:105835
ChEBI Name4-(3,4-dimethoxyphenyl)-2-(1-piperidinyl)-6-(trifluoromethyl)pyrimidine
Stars
DownloadsMolfile
FormulaC18H20F3N3O2
Net Charge0
Average Mass367.371
Monoisotopic Mass367.15076
SMILESCOc1ccc(-c2cc(C(F)(F)F)nc(N3CCCCC3)n2)cc1OC
InChIInChI=1S/C18H20F3N3O2/c1-25-14-7-6-12(10-15(14)26-2)13-11-16(18(19,20)21)23-17(22-13)24-8-4-3-5-9-24/h6-7,10-11H,3-5,8-9H2,1-2H3
InChIKeyQWTBMWLGTUEWKB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-(3,4-dimethoxyphenyl)-2-(1-piperidinyl)-6-(trifluoromethyl)pyrimidine (CHEBI:105835) is a pyrimidines (CHEBI:39447)
Manual XrefsDatabases
LSM-17196LINCS