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2'-[5-(p-Chlorophenyl)-1,3,4-oxadiazol-2-yl]-3,4-dimethoxybenzenesulfonanilide

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2'-[5-(p-Chlorophenyl)-1,3,4-oxadiazol-2-yl]-3,4-dimethoxybenzenesulfonanilide
SpectraBase Compound ID BSQamGXsYM3
InChI InChI=1S/C22H18ClN3O5S/c1-29-19-12-11-16(13-20(19)30-2)32(27,28)26-18-6-4-3-5-17(18)22-25-24-21(31-22)14-7-9-15(23)10-8-14/h3-13,26H,1-2H3
InChIKey KELJTAACOIUPCQ-UHFFFAOYSA-N
Mol Weight 471.92 g/mol
Molecular Formula C22H18ClN3O5S
Exact Mass 471.06557 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BaPDAY9PX0B
Name 2'-[5-(p-Chlorophenyl)-1,3,4-oxadiazol-2-yl]-3,4-dimethoxybenzenesulfonanilide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 471.065569561 u
Formula C22H18ClN3O5S
InChI InChI=1S/C22H18ClN3O5S/c1-29-19-12-11-16(13-20(19)30-2)32(27,28)26-18-6-4-3-5-17(18)22-25-24-21(31-22)14-7-9-15(23)10-8-14/h3-13,26H,1-2H3
InChIKey KELJTAACOIUPCQ-UHFFFAOYSA-N
Molecular Weight 471.915 g/mol
SMILES N(S(C1=CC=C(C(=C1)OC)OC)(=O)=O)C=1C=CC=CC1C1=NN=C(O1)C=1C=CC(=CC1)Cl