2-chloro-5-{5-[(E)-(1-(4-fluorophenyl)-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-furyl}benzoic acid

SpectraBase Compound ID	fwJBCqtLut
InChI	InChI=1S/C22H12ClFN2O5S/c23-17-7-1-11(9-15(17)21(29)30)18-8-6-14(31-18)10-16-19(27)25-22(32)26(20(16)28)13-4-2-12(24)3-5-13/h1-10H,(H,29,30)(H,25,27,32)/b16-10+
InChIKey	ZONAFSPRNLPYDE-MHWRWJLKSA-N Google Search
Mol Weight	470.86 g/mol
Molecular Formula	C22H12ClFN2O5S
Exact Mass	470.013949 g/mol

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SpectraBase Spectrum ID	2zbn7VgZqVU
Name	2-chloro-5-{5-[(E)-(1-(4-fluorophenyl)-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-furyl}benzoic acid
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/C22H12ClFN2O5S/c23-17-7-1-11(9-15(17)21(29)30)18-8-6-14(31-18)10-16-19(27)25-22(32)26(20(16)28)13-4-2-12(24)3-5-13/h1-10H,(H,29,30)(H,25,27,32)/b16-10+
InChIKey	ZONAFSPRNLPYDE-MHWRWJLKSA-N
NMR Offset	17.1563
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_3189
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: 113102; Labnumber: PAVL-06825; VK_ID: VK-003190
Synonyms	2-chloro-5-{5-[(1-(4-fluorophenyl)-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-furyl}benzoic acid
Temperature	308 °C