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3-pyridinecarboxylic acid, 5-cyano-4-(2-ethoxyphenyl)-1,2,3,4-tetrahydro-2-oxo-6-[[2-oxo-2-(2-thiazolylamino)ethyl]thio]-, ethyl ester

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3-pyridinecarboxylic acid, 5-cyano-4-(2-ethoxyphenyl)-1,2,3,4-tetrahydro-2-oxo-6-[[2-oxo-2-(2-thiazolylamino)ethyl]thio]-, ethyl ester
SpectraBase Compound ID CDYrITNQ2Gs
InChI InChI=1S/C22H22N4O5S2/c1-3-30-15-8-6-5-7-13(15)17-14(11-23)20(26-19(28)18(17)21(29)31-4-2)33-12-16(27)25-22-24-9-10-32-22/h5-10,17-18H,3-4,12H2,1-2H3,(H,26,28)(H,24,25,27)
InChIKey JITGLFMBEDAXOO-UHFFFAOYSA-N
Mol Weight 486.56 g/mol
Molecular Formula C22H22N4O5S2
Exact Mass 486.103162 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IBzMPCnHN18
Name 3-pyridinecarboxylic acid, 5-cyano-4-(2-ethoxyphenyl)-1,2,3,4-tetrahydro-2-oxo-6-[[2-oxo-2-(2-thiazolylamino)ethyl]thio]-, ethyl 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/C22H22N4O5S2/c1-3-30-15-8-6-5-7-13(15)17-14(11-23)20(26-19(28)18(17)21(29)31-4-2)33-12-16(27)25-22-24-9-10-32-22/h5-10,17-18H,3-4,12H2,1-2H3,(H,26,28)(H,24,25,27)
InChIKey JITGLFMBEDAXOO-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2271
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/11238576