EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:92397 - 4-(3,5-difluoroanilino)-6-(2,2-difluoroethylamino)-1,3,5-triazine-2-carbonitrile

ChEBI IDCHEBI:92397
ChEBI Name4-(3,5-difluoroanilino)-6-(2,2-difluoroethylamino)-1,3,5-triazine-2-carbonitrile
Stars
DownloadsMolfile
FormulaC12H8F4N6
Net Charge0
Average Mass312.230
Monoisotopic Mass312.07466
SMILESN#Cc1nc(NCC(F)F)nc(Nc2cc(F)cc(F)c2)n1
InChIInChI=1S/C12H8F4N6/c13-6-1-7(14)3-8(2-6)19-12-21-10(4-17)20-11(22-12)18-5-9(15)16/h1-3,9H,5H2,(H2,18,19,20,21,22)
InChIKeyVCHWTZGSALOUAW-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
4-(3,5-difluoroanilino)-6-(2,2-difluoroethylamino)-1,3,5-triazine-2-carbonitrile (CHEBI:92397) is a diamino-1,3,5-triazine (CHEBI:38170)
Manual XrefsDatabases
LSM-2494LINCS