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CHEBI:126853 - N-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-[2-[4-(trifluoromethyl)phenyl]ethynyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylbenzenesulfonamide

ChEBI IDCHEBI:126853
ChEBI NameN-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-[2-[4-(trifluoromethyl)phenyl]ethynyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylbenzenesulfonamide
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DownloadsMolfile
FormulaC30H30F3N3O5S
Net Charge0
Average Mass601.647
Monoisotopic Mass601.18583
SMILESC[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ncc(C#Cc3ccc(C(F)(F)F)cc3)cc2C1=O
InChIInChI=1S/C30H30F3N3O5S/c1-20-17-36(21(2)19-37)29(38)26-15-23(10-9-22-11-13-24(14-12-22)30(31,32)33)16-34-28(26)41-27(20)18-35(3)42(39,40)25-7-5-4-6-8-25/h4-8,11-16,20-21,27,37H,17-19H2,1-3H3/t20-,21+,27-/m0/s1
InChIKeyHYHNGJQOQBBFBA-ISCCLHIJSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-[2-[4-(trifluoromethyl)phenyl]ethynyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylbenzenesulfonamide (CHEBI:126853) is a sulfonamide (CHEBI:35358)
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