(5E)-1-(4-bromophenyl)-5-{[3-chloro-4-(4-morpholinyl)anilino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione

SpectraBase Compound ID	2pV8dgA5QbX
InChI	InChI=1S/C21H18BrClN4O4/c22-13-1-4-15(5-2-13)27-20(29)16(19(28)25-21(27)30)12-24-14-3-6-18(17(23)11-14)26-7-9-31-10-8-26/h1-6,11-12,24H,7-10H2,(H,25,28,30)/b16-12+
InChIKey	XUURBTCDPDHEPC-FOWTUZBSSA-N Google Search
Mol Weight	505.76 g/mol
Molecular Formula	C21H18BrClN4O4
Exact Mass	504.019996 g/mol

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SpectraBase Spectrum ID	AlbWlDVYtkO
Name	(5E)-1-(4-bromophenyl)-5-{[3-chloro-4-(4-morpholinyl)anilino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
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/C21H18BrClN4O4/c22-13-1-4-15(5-2-13)27-20(29)16(19(28)25-21(27)30)12-24-14-3-6-18(17(23)11-14)26-7-9-31-10-8-26/h1-6,11-12,24H,7-10H2,(H,25,28,30)/b16-12+
InChIKey	XUURBTCDPDHEPC-FOWTUZBSSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_13586
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: D86287; Labnumber: KV-2518; SBI_ID: SBI-013589
Synonyms	1-(4-bromophenyl)-5-{[3-chloro-4-(4-morpholinyl)anilino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature	308 °C