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5-chloro-2-methoxy-N-[2-[4-methoxy-3-(methyl-(methylthiocarbamoyl)sulfamoyl)phenyl]ethyl]benzamide
SpectraBase Compound ID 9Q42NeqLcnW
InChI InChI=1S/C20H24ClN3O5S2/c1-22-20(30)24(2)31(26,27)18-11-13(5-7-17(18)29-4)9-10-23-19(25)15-12-14(21)6-8-16(15)28-3/h5-8,11-12H,9-10H2,1-4H3,(H,22,30)(H,23,25)
InChIKey WXOJFGQYLHCFJO-UHFFFAOYSA-N
Mol Weight 486.0 g/mol
Molecular Formula C20H24ClN3O5S2
Exact Mass 485.084591 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jgw1zW1xm1C
Name 5-chloro-2-methoxy-N-[2-[4-methoxy-3-(methyl-(methylthiocarbamoyl)sulfamoyl)phenyl]ethyl]benzamide
Compound Number 2165
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H24ClN3O5S2
InChI InChI=1S/C20H24ClN3O5S2/c1-22-20(30)24(2)31(26,27)18-11-13(5-7-17(18)29-4)9-10-23-19(25)15-12-14(21)6-8-16(15)28-3/h5-8,11-12H,9-10H2,1-4H3,(H,22,30)(H,23,25)
InChIKey WXOJFGQYLHCFJO-UHFFFAOYSA-N
Literature Reference Author W.ROBIEN
Literature Reference Citation W.ROBIEN,PRIVATE_COMMUNICATION
Molecular Weight 486.001 g/mol
Sample ID 2538
Solvent DMSO-D6