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(5E)-1-(2,4-dimethoxyphenyl)-5-{[2,5-dimethyl-1-(4-pyridinyl)-1H-pyrrol-3-yl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

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(5E)-1-(2,4-dimethoxyphenyl)-5-{[2,5-dimethyl-1-(4-pyridinyl)-1H-pyrrol-3-yl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID FfLPhxh25Ya
InChI InChI=1S/C24H22N4O4S/c1-14-11-16(15(2)27(14)17-7-9-25-10-8-17)12-19-22(29)26-24(33)28(23(19)30)20-6-5-18(31-3)13-21(20)32-4/h5-13H,1-4H3,(H,26,29,33)/b19-12+
InChIKey BKMYLLYLROZSPT-XDHOZWIPSA-N
Mol Weight 462.52 g/mol
Molecular Formula C24H22N4O4S
Exact Mass 462.136176 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6odDx3KcTm
Name (5E)-1-(2,4-dimethoxyphenyl)-5-{[2,5-dimethyl-1-(4-pyridinyl)-1H-pyrrol-3-yl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
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/C24H22N4O4S/c1-14-11-16(15(2)27(14)17-7-9-25-10-8-17)12-19-22(29)26-24(33)28(23(19)30)20-6-5-18(31-3)13-21(20)32-4/h5-13H,1-4H3,(H,26,29,33)/b19-12+
InChIKey BKMYLLYLROZSPT-XDHOZWIPSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_8369
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: D36181; Labnumber: SPDEM5-38162; SBI_ID: SBI-008372
Synonyms 1-(2,4-dimethoxyphenyl)-5-{[2,5-dimethyl-1-(4-pyridinyl)-1H-pyrrol-3-yl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 318 °C