EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:92894 - 4-[(1-methyl-5-tetrazolyl)thio]-5-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine

ChEBI IDCHEBI:92894
ChEBI Name4-[(1-methyl-5-tetrazolyl)thio]-5-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine
Stars
Last Modified6 March 2019
DownloadsMolfile
FormulaC15H9F3N6S2
Net Charge0
Average Mass394.407
Monoisotopic Mass394.02822
SMILESCn1nnnc1Sc1ncnc2scc(-c3ccccc3C(F)(F)F)c12
InChIInChI=1S/C15H9F3N6S2/c1-24-14(21-22-23-24)26-13-11-9(6-25-12(11)19-7-20-13)8-4-2-3-5-10(8)15(16,17)18/h2-7H,1H3
InChIKeyPPVZUZPOOWQBMA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[(1-methyl-5-tetrazolyl)thio]-5-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine (CHEBI:92894) is a aryl sulfide (CHEBI:35683)
4-[(1-methyl-5-tetrazolyl)thio]-5-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine (CHEBI:92894) is a thienopyrimidine (CHEBI:143212)
Manual XrefsDatabases
LSM-3136LINCS