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2-[(4-ETHYLPHENOXY)-METHYL]-N-(2,4-DIBROMOPHENYL-CARBAMOTHIOYL)-BENZAMIDE
SpectraBase Compound ID E5uRoYIn8NG
InChI InChI=1S/C23H20Br2N2O2S/c1-2-15-7-10-18(11-8-15)29-14-16-5-3-4-6-19(16)22(28)27-23(30)26-21-12-9-17(24)13-20(21)25/h3-13H,2,14H2,1H3,(H2,26,27,28,30)
InChIKey SPICIWQUWNQINN-UHFFFAOYSA-N
Mol Weight 548.29 g/mol
Molecular Formula C23H20Br2N2O2S
Exact Mass 545.961225 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F2seKc6L7dL
Name 2-[(4-ETHYLPHENOXY)-METHYL]-N-(2,4-DIBROMOPHENYL-CARBAMOTHIOYL)-BENZAMIDE
Compound Number 1E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H20Br2N2O2S
InChI InChI=1S/C23H20Br2N2O2S/c1-2-15-7-10-18(11-8-15)29-14-16-5-3-4-6-19(16)22(28)27-23(30)26-21-12-9-17(24)13-20(21)25/h3-13H,2,14H2,1H3,(H2,26,27,28,30)
InChIKey SPICIWQUWNQINN-UHFFFAOYSA-N
Literature Reference Author C.LIMBAN,A.V.MISSIR,K.M.S.FAHELELBOM,M.M.AL-TABAKHA,M.T.CAPR OIU,B.SADEK
Literature Reference Citation DRUG.DES.DEV.THERAPY,7,883(2013)
Molecular Weight 548.292 g/mol
Sample ID 73306
Solvent DMSO-D6