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CHEBI:95548 - 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-methyl-2-thiophenesulfonamide

ChEBI IDCHEBI:95548
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-methyl-2-thiophenesulfonamide
Stars
DownloadsMolfile
FormulaC28H28F3N3O5S2
Net Charge0
Average Mass607.676
Monoisotopic Mass607.14225
SMILESC[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)Oc2ncc(C#Cc3ccc(C(F)(F)F)cc3)cc2C1=O
InChIInChI=1S/C28H28F3N3O5S2/c1-18-15-34(19(2)17-35)27(36)23-13-21(7-6-20-8-10-22(11-9-20)28(29,30)31)14-32-26(23)39-24(18)16-33(3)41(37,38)25-5-4-12-40-25/h4-5,8-14,18-19,24,35H,15-17H2,1-3H3/t18-,19+,24-/m0/s1
InChIKeyBZYDVGAUUQCKCK-GLDPYIMESA-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-methyl-2-thiophenesulfonamide (CHEBI:95548) is a (trifluoromethyl)benzenes (CHEBI:83565)
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