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3-pyridinecarboxylic acid, 5-cyano-6-[[2-[(3,4-dimethylphenyl)amino]-2-oxoethyl]thio]-4-(2-fluorophenyl)-1,2,3,4-tetrahydro-2-oxo-, methyl ester

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3-pyridinecarboxylic acid, 5-cyano-6-[[2-[(3,4-dimethylphenyl)amino]-2-oxoethyl]thio]-4-(2-fluorophenyl)-1,2,3,4-tetrahydro-2-oxo-, methyl ester
SpectraBase Compound ID 6Q3xLz2nogW
InChI InChI=1S/C24H22FN3O4S/c1-13-8-9-15(10-14(13)2)27-19(29)12-33-23-17(11-26)20(16-6-4-5-7-18(16)25)21(22(30)28-23)24(31)32-3/h4-10,20-21H,12H2,1-3H3,(H,27,29)(H,28,30)
InChIKey WFVFWIOJPICUNP-UHFFFAOYSA-N
Mol Weight 467.52 g/mol
Molecular Formula C24H22FN3O4S
Exact Mass 467.131506 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4whql3mc57Y
Name 3-pyridinecarboxylic acid, 5-cyano-6-[[2-[(3,4-dimethylphenyl)amino]-2-oxoethyl]thio]-4-(2-fluorophenyl)-1,2,3,4-tetrahydro-2-oxo-, methyl ester
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C24H22FN3O4S/c1-13-8-9-15(10-14(13)2)27-19(29)12-33-23-17(11-26)20(16-6-4-5-7-18(16)25)21(22(30)28-23)24(31)32-3/h4-10,20-21H,12H2,1-3H3,(H,27,29)(H,28,30)
InChIKey WFVFWIOJPICUNP-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2309
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/11238634