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CHEBI:113679 - N-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-1-methyl-4-imidazolesulfonamide

ChEBI IDCHEBI:113679
ChEBI NameN-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-1-methyl-4-imidazolesulfonamide
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FormulaC21H31N5O5S
Net Charge0
Average Mass465.576
Monoisotopic Mass465.20459
SMILESCNC[C@H]1Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2CC(=O)N([C@H](C)CO)C[C@@H]1C
InChIInChI=1S/C21H31N5O5S/c1-14-10-26(15(2)12-27)21(28)8-16-7-17(5-6-18(16)31-19(14)9-22-3)24-32(29,30)20-11-25(4)13-23-20/h5-7,11,13-15,19,22,24,27H,8-10,12H2,1-4H3/t14-,15+,19+/m0/s1
InChIKeyCHBVISFKEYYRMC-QMTMVMCOSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-1-methyl-4-imidazolesulfonamide (CHEBI:113679) is a sulfonamide (CHEBI:35358)
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