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CHEBI:124831 - 4-chloro-N-[(2R,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]benzenesulfonamide

ChEBI IDCHEBI:124831
ChEBI Name4-chloro-N-[(2R,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]benzenesulfonamide
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FormulaC26H34ClN3O5S
Net Charge0
Average Mass536.094
Monoisotopic Mass535.19077
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2O[C@H]1CN(C)CC1CC1
InChIInChI=1S/C26H34ClN3O5S/c1-17-13-30(18(2)16-31)26(32)23-12-21(28-36(33,34)22-9-6-20(27)7-10-22)8-11-24(23)35-25(17)15-29(3)14-19-4-5-19/h6-12,17-19,25,28,31H,4-5,13-16H2,1-3H3/t17-,18-,25+/m1/s1
InChIKeyLRWRZSQCEACSFH-GAKIBJFNSA-N
ChEBI Ontology
Outgoing Relation(s)
4-chloro-N-[(2R,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]benzenesulfonamide (CHEBI:124831) is a sulfonamide (CHEBI:35358)
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