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(5Z)-1-(2,3-dimethylphenyl)-5-{[1-(4-hydroxyphenyl)-1H-pyrrol-2-yl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID LmRvmTVFEIa
InChI InChI=1S/C23H19N3O3S/c1-14-5-3-7-20(15(14)2)26-22(29)19(21(28)24-23(26)30)13-17-6-4-12-25(17)16-8-10-18(27)11-9-16/h3-13,27H,1-2H3,(H,24,28,30)/b19-13-
InChIKey HRONMFDVBKLZGI-UYRXBGFRSA-N
Mol Weight 417.48 g/mol
Molecular Formula C23H19N3O3S
Exact Mass 417.114713 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 92GyHICbJKJ
Name (5Z)-1-(2,3-dimethylphenyl)-5-{[1-(4-hydroxyphenyl)-1H-pyrrol-2-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/C23H19N3O3S/c1-14-5-3-7-20(15(14)2)26-22(29)19(21(28)24-23(26)30)13-17-6-4-12-25(17)16-8-10-18(27)11-9-16/h3-13,27H,1-2H3,(H,24,28,30)/b19-13-
InChIKey HRONMFDVBKLZGI-UYRXBGFRSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_8439
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: D36216; Labnumber: SPDEM5-38517; SBI_ID: SBI-008442
Synonyms 1-(2,3-dimethylphenyl)-5-{[1-(4-hydroxyphenyl)-1H-pyrrol-2-yl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 315 °C