CHEBI:108764 - 4-fluoro-N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]benzenesulfonamide

ChEBI IDCHEBI:108764
ChEBI Name4-fluoro-N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]benzenesulfonamide
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FormulaC22H28FN3O5S
Net Charge0
Average Mass465.547
Monoisotopic Mass465.17337
SMILESCNC[C@@H]1Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C(=O)N([C@@H](C)CO)C[C@H]1C
InChIInChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)18-5-4-6-19(21(18)31-20(14)11-24-3)25-32(29,30)17-9-7-16(23)8-10-17/h4-10,14-15,20,24-25,27H,11-13H2,1-3H3/t14-,15+,20+/m1/s1
InChIKeyRAWZADNKXQBMBA-SIFCLUCFSA-N
ChEBI Ontology
Outgoing Relation(s)
4-fluoro-N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]benzenesulfonamide (CHEBI:108764) is a sulfonamide (CHEBI:35358)
Manual XrefsDatabases
LSM-20163LINCS