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

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(5E)-1-(4-fluorophenyl)-5-{[1-(4-hydroxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID IRunBo1J6Zu
InChI InChI=1S/C23H18FN3O3S/c1-13-11-15(14(2)26(13)17-7-9-19(28)10-8-17)12-20-21(29)25-23(31)27(22(20)30)18-5-3-16(24)4-6-18/h3-12,28H,1-2H3,(H,25,29,31)/b20-12+
InChIKey HLXDQUHUZRNGLV-UDWIEESQSA-N
Mol Weight 435.47 g/mol
Molecular Formula C23H18FN3O3S
Exact Mass 435.105291 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8oPcTirAKNT
Name (5E)-1-(4-fluorophenyl)-5-{[1-(4-hydroxyphenyl)-2,5-dimethyl-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/C23H18FN3O3S/c1-13-11-15(14(2)26(13)17-7-9-19(28)10-8-17)12-20-21(29)25-23(31)27(22(20)30)18-5-3-16(24)4-6-18/h3-12,28H,1-2H3,(H,25,29,31)/b20-12+
InChIKey HLXDQUHUZRNGLV-UDWIEESQSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22802
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: D35831; Labnumber: SPDEM4-15203; SBI_ID: SBI-022806
Synonyms 1-(4-fluorophenyl)-5-{[1-(4-hydroxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 308 °C