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3-thiophenecarboxylic acid, 2-[(4-chloro-3-nitrobenzoyl)amino]-5-[[[2-chloro-5-(trifluoromethyl)phenyl]amino]carbonyl]-4-methyl-, ethyl ester

View entire compound with spectra: 1 NMR

3-thiophenecarboxylic acid, 2-[(4-chloro-3-nitrobenzoyl)amino]-5-[[[2-chloro-5-(trifluoromethyl)phenyl]amino]carbonyl]-4-methyl-, ethyl ester
SpectraBase Compound ID 8l1z92SL7q0
InChI InChI=1S/C23H16Cl2F3N3O6S/c1-3-37-22(34)17-10(2)18(20(33)29-15-9-12(23(26,27)28)5-7-13(15)24)38-21(17)30-19(32)11-4-6-14(25)16(8-11)31(35)36/h4-9H,3H2,1-2H3,(H,29,33)(H,30,32)
InChIKey JWIJPKGDQGUNPG-UHFFFAOYSA-N
Mol Weight 590.36 g/mol
Molecular Formula C23H16Cl2F3N3O6S
Exact Mass 589.008896 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2G42OBrReMu
Name 3-thiophenecarboxylic acid, 2-[(4-chloro-3-nitrobenzoyl)amino]-5-[[[2-chloro-5-(trifluoromethyl)phenyl]amino]carbonyl]-4-methyl-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 589.008896304 u
Formula C23H16Cl2F3N3O6S
InChI InChI=1S/C23H16Cl2F3N3O6S/c1-3-37-22(34)17-10(2)18(20(33)29-15-9-12(23(26,27)28)5-7-13(15)24)38-21(17)30-19(32)11-4-6-14(25)16(8-11)31(35)36/h4-9H,3H2,1-2H3,(H,29,33)(H,30,32)
InChIKey JWIJPKGDQGUNPG-UHFFFAOYSA-N
Molecular Weight 590.357 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4043
Solvent DMSO-d6
Source Vendor ID: NMR/9290418; Lab Info: SAS; Lab Number: SAS-TST2813
Temperature 29.85 °C