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2-[(4-ETHYLPHENOXY)-METHYL]-N-(3-NITROPHENYL-CARBAMOTHIOYL)-BENZAMIDE
SpectraBase Compound ID D7VnXuRzgum
InChI InChI=1S/C23H21N3O4S/c1-2-16-10-12-20(13-11-16)30-15-17-6-3-4-9-21(17)22(27)25-23(31)24-18-7-5-8-19(14-18)26(28)29/h3-14H,2,15H2,1H3,(H2,24,25,27,31)
InChIKey DSMFESNBYLHRSR-UHFFFAOYSA-N
Mol Weight 435.5 g/mol
Molecular Formula C23H21N3O4S
Exact Mass 435.125277 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CUcr4bABTqV
Name 2-[(4-ETHYLPHENOXY)-METHYL]-N-(3-NITROPHENYL-CARBAMOTHIOYL)-BENZAMIDE
Compound Number 1H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H21N3O4S
InChI InChI=1S/C23H21N3O4S/c1-2-16-10-12-20(13-11-16)30-15-17-6-3-4-9-21(17)22(27)25-23(31)24-18-7-5-8-19(14-18)26(28)29/h3-14H,2,15H2,1H3,(H2,24,25,27,31)
InChIKey DSMFESNBYLHRSR-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 435.497 g/mol
Sample ID 73309
Solvent DMSO-D6