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(5E)-1-(3,4-dimethylphenyl)-5-{[1-(4-methoxyphenyl)-1H-pyrrol-2-yl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID DLXaklcJoSu
InChI InChI=1S/C24H21N3O3S/c1-15-6-7-19(13-16(15)2)27-23(29)21(22(28)25-24(27)31)14-18-5-4-12-26(18)17-8-10-20(30-3)11-9-17/h4-14H,1-3H3,(H,25,28,31)/b21-14+
InChIKey FNHNVZNDICOTEC-KGENOOAVSA-N
Mol Weight 431.51 g/mol
Molecular Formula C24H21N3O3S
Exact Mass 431.130363 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5UyDTjAbnmd
Name (5E)-1-(3,4-dimethylphenyl)-5-{[1-(4-methoxyphenyl)-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/C24H21N3O3S/c1-15-6-7-19(13-16(15)2)27-23(29)21(22(28)25-24(27)31)14-18-5-4-12-26(18)17-8-10-20(30-3)11-9-17/h4-14H,1-3H3,(H,25,28,31)/b21-14+
InChIKey FNHNVZNDICOTEC-KGENOOAVSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10100
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: 1001224; UBI_ID: UBI-010103
Synonyms 1-(3,4-dimethylphenyl)-5-{[1-(4-methoxyphenyl)-1H-pyrrol-2-yl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 315 °C