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CHEBI:124727 - N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-1-methyl-4-imidazolesulfonamide

ChEBI IDCHEBI:124727
ChEBI NameN-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-1-methyl-4-imidazolesulfonamide
Stars
DownloadsMolfile
FormulaC29H36F3N5O5S
Net Charge0
Average Mass623.698
Monoisotopic Mass623.23892
SMILESC[C@H]1CN([C@@H](C)CO)C(=O)Cc2cc(NS(=O)(=O)c3cn(C)cn3)ccc2O[C@H]1CN(C)Cc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C29H36F3N5O5S/c1-19-13-37(20(2)17-38)28(39)12-22-11-24(34-43(40,41)27-16-36(4)18-33-27)9-10-25(22)42-26(19)15-35(3)14-21-5-7-23(8-6-21)29(30,31)32/h5-11,16,18-20,26,34,38H,12-15,17H2,1-4H3/t19-,20-,26-/m0/s1
InChIKeyZUOFRGRNPVMREM-DYLHXGEVSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-1-methyl-4-imidazolesulfonamide (CHEBI:124727) is a sulfonamide (CHEBI:35358)
Manual XrefsDatabases
LSM-36169LINCS