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

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(5E)-5-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylene}-1-(4-methylphenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID LQZ3OkXYgVt
InChI InChI=1S/C24H20N4O4S/c1-14-4-6-19(7-5-14)27-23(30)21(22(29)25-24(27)33)13-17-12-15(2)26(16(17)3)18-8-10-20(11-9-18)28(31)32/h4-13H,1-3H3,(H,25,29,33)/b21-13+
InChIKey DUISTVSWODOTSU-FYJGNVAPSA-N
Mol Weight 460.51 g/mol
Molecular Formula C24H20N4O4S
Exact Mass 460.120526 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AK6L10gghGd
Name (5E)-5-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylene}-1-(4-methylphenyl)-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/C24H20N4O4S/c1-14-4-6-19(7-5-14)27-23(30)21(22(29)25-24(27)33)13-17-12-15(2)26(16(17)3)18-8-10-20(11-9-18)28(31)32/h4-13H,1-3H3,(H,25,29,33)/b21-13+
InChIKey DUISTVSWODOTSU-FYJGNVAPSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_3204
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: 113119; Labnumber: PAVL-06890; VK_ID: VK-003205
Synonyms 5-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylene}-1-(4-methylphenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 308 °C