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3-pyridinecarboxylic acid, 6-[[2-[(4-acetylphenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-2-methyl-4-(2-thienyl)-, 2-propenyl ester

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3-pyridinecarboxylic acid, 6-[[2-[(4-acetylphenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-2-methyl-4-(2-thienyl)-, 2-propenyl ester
SpectraBase Compound ID 8JAoIfxv4dU
InChI InChI=1S/C25H23N3O4S2/c1-4-11-32-25(31)22-15(2)27-24(19(13-26)23(22)20-6-5-12-33-20)34-14-21(30)28-18-9-7-17(8-10-18)16(3)29/h4-10,12,23,27H,1,11,14H2,2-3H3,(H,28,30)
InChIKey HLZXXGPYVKPHNK-UHFFFAOYSA-N
Mol Weight 493.6 g/mol
Molecular Formula C25H23N3O4S2
Exact Mass 493.112999 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BDiJ21yP0WZ
Name 3-pyridinecarboxylic acid, 6-[[2-[(4-acetylphenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-2-methyl-4-(2-thienyl)-, 2-propenyl 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/C25H23N3O4S2/c1-4-11-32-25(31)22-15(2)27-24(19(13-26)23(22)20-6-5-12-33-20)34-14-21(30)28-18-9-7-17(8-10-18)16(3)29/h4-10,12,23,27H,1,11,14H2,2-3H3,(H,28,30)
InChIKey HLZXXGPYVKPHNK-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2504
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/11238877