EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:99526 - 2-fluoro-N-[(2R,3S)-4-[(4-fluorophenyl)sulfonyl-[(2R)-1-hydroxypropan-2-yl]amino]-2-methoxy-3-methylbutyl]-N-methylbenzamide

ChEBI IDCHEBI:99526
ChEBI Name2-fluoro-N-[(2R,3S)-4-[(4-fluorophenyl)sulfonyl-[(2R)-1-hydroxypropan-2-yl]amino]-2-methoxy-3-methylbutyl]-N-methylbenzamide
Stars
DownloadsMolfile
FormulaC23H30F2N2O5S
Net Charge0
Average Mass484.565
Monoisotopic Mass484.18435
SMILESCO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22-/m0/s1
InChIKeyPIEMZAFCKVBYBS-JKSBSHDWSA-N
ChEBI Ontology
Outgoing Relation(s)
2-fluoro-N-[(2R,3S)-4-[(4-fluorophenyl)sulfonyl-[(2R)-1-hydroxypropan-2-yl]amino]-2-methoxy-3-methylbutyl]-N-methylbenzamide (CHEBI:99526) is a sulfonamide (CHEBI:35358)
Manual XrefsDatabases
LSM-10905LINCS