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N-4-TOLUENESULFONYLUREIDO-N-2-CHLOROBENZYL-L-ALANINE-HYDROXAMATE
SpectraBase Compound ID KnT6UVn42ab
InChI InChI=1S/C18H20ClN3O5S/c1-12-7-9-15(10-8-12)28(26,27)21-18(24)22(13(2)17(23)20-25)11-14-5-3-4-6-16(14)19/h3-10,13,25H,11H2,1-2H3,(H,20,23)(H,21,24)
InChIKey LMQQBOUHWXHRCY-UHFFFAOYSA-N
Mol Weight 425.89 g/mol
Molecular Formula C18H20ClN3O5S
Exact Mass 425.08122 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GRXDG1M18Sq
Name N-4-TOLUENESULFONYLUREIDO-N-2-CHLOROBENZYL-L-ALANINE-HYDROXAMATE
Compound Number D3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H19ClN3O5S
InChI InChI=1S/C18H20ClN3O5S/c1-12-7-9-15(10-8-12)28(26,27)21-18(24)22(13(2)17(23)20-25)11-14-5-3-4-6-16(14)19/h3-10,13,25H,11H2,1-2H3,(H,20,23)(H,21,24)
InChIKey LMQQBOUHWXHRCY-UHFFFAOYSA-N
Literature Reference Author A.SCOZZAFAVA,C.T.SUPURAN
Literature Reference Citation BIOORG.MED.CHEM.,8,637(2000)
Literature Reference DOI 10.1016/S0968-0896(99)00316-8
Molecular Weight 424.879 g/mol
Solvent DMSO-D6
Source File Reference UWVN20149