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2-((5E)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2,4-dioxo-1,3-thiazolidin-3-yl)-N-(4-methylphenyl)acetamide

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2-((5E)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2,4-dioxo-1,3-thiazolidin-3-yl)-N-(4-methylphenyl)acetamide
SpectraBase Compound ID JFekoUwakTS
InChI InChI=1S/C25H22FN3O3S/c1-15-4-8-20(9-5-15)27-23(30)14-28-24(31)22(33-25(28)32)13-18-12-16(2)29(17(18)3)21-10-6-19(26)7-11-21/h4-13H,14H2,1-3H3,(H,27,30)/b22-13+
InChIKey QMXRLEULQOKYBQ-LPYMAVHISA-N
Mol Weight 463.53 g/mol
Molecular Formula C25H22FN3O3S
Exact Mass 463.136591 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5CdUSH4og7m
Name 2-((5E)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2,4-dioxo-1,3-thiazolidin-3-yl)-N-(4-methylphenyl)acetamide
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/C25H22FN3O3S/c1-15-4-8-20(9-5-15)27-23(30)14-28-24(31)22(33-25(28)32)13-18-12-16(2)29(17(18)3)21-10-6-19(26)7-11-21/h4-13H,14H2,1-3H3,(H,27,30)/b22-13+
InChIKey QMXRLEULQOKYBQ-LPYMAVHISA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11816
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: 1003592; UBI_ID: UBI-011819
Synonyms 2-(5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2,4-dioxo-1,3-thiazolidin-3-yl)-N-(4-methylphenyl)acetamide
Temperature 318 °C