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2-[(4-ETHYLPHENOXY)-METHYL]-N-(3-TRIFLUOROMETHYLPHENYL-CARBAMOTHIOYL)-BENZAMIDE

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2-[(4-ETHYLPHENOXY)-METHYL]-N-(3-TRIFLUOROMETHYLPHENYL-CARBAMOTHIOYL)-BENZAMIDE
SpectraBase Compound ID 6BstFAAWbNp
InChI InChI=1S/C24H21F3N2O2S/c1-2-16-10-12-20(13-11-16)31-15-17-6-3-4-9-21(17)22(30)29-23(32)28-19-8-5-7-18(14-19)24(25,26)27/h3-14H,2,15H2,1H3,(H2,28,29,30,32)
InChIKey UTKCVBHWOYDXOT-UHFFFAOYSA-N
Mol Weight 458.5 g/mol
Molecular Formula C24H21F3N2O2S
Exact Mass 458.127584 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GeYu0y8VpBP
Name 2-[(4-ETHYLPHENOXY)-METHYL]-N-(3-TRIFLUOROMETHYLPHENYL-CARBAMOTHIOYL)-BENZAMIDE
Compound Number 1G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H21F3N2O2S
InChI InChI=1S/C24H21F3N2O2S/c1-2-16-10-12-20(13-11-16)31-15-17-6-3-4-9-21(17)22(30)29-23(32)28-19-8-5-7-18(14-19)24(25,26)27/h3-14H,2,15H2,1H3,(H2,28,29,30,32)
InChIKey UTKCVBHWOYDXOT-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)
Solvent DMSO-D6
Source File Reference UWLU73308