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CHEBI:111767 - N-[(2S,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2-thiophenesulfonamide

ChEBI IDCHEBI:111767
ChEBI NameN-[(2S,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2-thiophenesulfonamide
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DownloadsMolfile
FormulaC24H33N3O5S2
Net Charge0
Average Mass507.678
Monoisotopic Mass507.18616
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)c2cccc(NS(=O)(=O)c3cccs3)c2O[C@@H]1CN(C)CC1CC1
InChIInChI=1S/C24H33N3O5S2/c1-16-12-27(17(2)15-28)24(29)19-6-4-7-20(25-34(30,31)22-8-5-11-33-22)23(19)32-21(16)14-26(3)13-18-9-10-18/h4-8,11,16-18,21,25,28H,9-10,12-15H2,1-3H3/t16-,17-,21-/m1/s1
InChIKeyJSDMQXJTQZGOQF-CBGDNZLLSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2-thiophenesulfonamide (CHEBI:111767) is a sulfonamide (CHEBI:35358)
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