2-chloro-4-{3-[(Z)-(1-(2-fluorophenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoic acid

SpectraBase Compound ID	Er6hnVZBPhH
InChI	InChI=1S/C24H17ClFN3O5/c1-12-9-14(13(2)28(12)15-7-8-16(23(32)33)18(25)11-15)10-17-21(30)27-24(34)29(22(17)31)20-6-4-3-5-19(20)26/h3-11H,1-2H3,(H,32,33)(H,27,30,34)/b17-10-
InChIKey	MYAUAPKQJAIKIO-YVLHZVERSA-N Google Search
Mol Weight	481.87 g/mol
Molecular Formula	C24H17ClFN3O5
Exact Mass	481.084077 g/mol

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SpectraBase Spectrum ID	8SuYX6ghss8
Name	2-chloro-4-{3-[(Z)-(1-(2-fluorophenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}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/C24H17ClFN3O5/c1-12-9-14(13(2)28(12)15-7-8-16(23(32)33)18(25)11-15)10-17-21(30)27-24(34)29(22(17)31)20-6-4-3-5-19(20)26/h3-11H,1-2H3,(H,32,33)(H,27,30,34)/b17-10-
InChIKey	MYAUAPKQJAIKIO-YVLHZVERSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_10356
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: 1000715; UBI_ID: UBI-010359
Synonyms	2-chloro-4-{3-[(1-(2-fluorophenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoic acid
Temperature	315 °C