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CHEBI:128718 - 1-[(2R,3S)-2-[[(4-chlorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-cyclohexylurea

ChEBI IDCHEBI:128718
ChEBI Name1-[(2R,3S)-2-[[(4-chlorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-cyclohexylurea
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FormulaC29H39ClN4O6S
Net Charge0
Average Mass607.173
Monoisotopic Mass606.22788
SMILESC[C@H]1CN([C@@H](C)CO)C(=O)c2cccc(NC(=O)NC3CCCCC3)c2O[C@H]1CN(C)S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C29H39ClN4O6S/c1-19-16-34(20(2)18-35)28(36)24-10-7-11-25(32-29(37)31-22-8-5-4-6-9-22)27(24)40-26(19)17-33(3)41(38,39)23-14-12-21(30)13-15-23/h7,10-15,19-20,22,26,35H,4-6,8-9,16-18H2,1-3H3,(H2,31,32,37)/t19-,20-,26-/m0/s1
InChIKeyRZUBMKQOOJPJTH-DYLHXGEVSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(2R,3S)-2-[[(4-chlorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-cyclohexylurea (CHEBI:128718) is a sulfonamide (CHEBI:35358)
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