EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:94506 - 4-[[5-amino-1-[(2,6-difluorophenyl)-oxomethyl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide

ChEBI IDCHEBI:94506
ChEBI Name4-[[5-amino-1-[(2,6-difluorophenyl)-oxomethyl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide
Stars
DownloadsMolfile
FormulaC15H12F2N6O3S
Net Charge0
Average Mass394.363
Monoisotopic Mass394.06597
SMILESNc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1C(=O)c1c(F)cccc1F
InChIInChI=1S/C15H12F2N6O3S/c16-10-2-1-3-11(17)12(10)13(24)23-14(18)21-15(22-23)20-8-4-6-9(7-5-8)27(19,25)26/h1-7H,(H2,19,25,26)(H3,18,20,21,22)
InChIKeyKDKUVYLMPJIGKA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[[5-amino-1-[(2,6-difluorophenyl)-oxomethyl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide (CHEBI:94506) is a sulfonamide (CHEBI:35358)
Manual XrefsDatabases
LSM-5294LINCS