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CHEBI:123906 - 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-10-yl]benzenesulfonamide

ChEBI IDCHEBI:123906
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-10-yl]benzenesulfonamide
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DownloadsMolfile
FormulaC26H34ClN3O5S
Net Charge0
Average Mass536.094
Monoisotopic Mass535.19077
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)c2cccc(NS(=O)(=O)c3ccc(Cl)cc3)c2O[C@H]1CN(C)CC1CC1
InChIInChI=1S/C26H34ClN3O5S/c1-17-13-30(18(2)16-31)26(32)22-5-4-6-23(28-36(33,34)21-11-9-20(27)10-12-21)25(22)35-24(17)15-29(3)14-19-7-8-19/h4-6,9-12,17-19,24,28,31H,7-8,13-16H2,1-3H3/t17-,18-,24+/m1/s1
InChIKeyQGNVKOPRWJDOFN-GGUMNFRJSA-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-10-yl]benzenesulfonamide (CHEBI:123906) is a sulfonamide (CHEBI:35358)
Manual XrefsDatabases
LSM-35348LINCS