(5E)-1-(4-fluorobenzyl)-5-{[(4-methyl-1-piperazinyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione

SpectraBase Compound ID	K4mxxovo8S8
InChI	InChI=1S/C17H20FN5O3/c1-21-6-8-22(9-7-21)19-10-14-15(24)20-17(26)23(16(14)25)11-12-2-4-13(18)5-3-12/h2-5,10,19H,6-9,11H2,1H3,(H,20,24,26)/b14-10+
InChIKey	BAVPSNHVLTVZKX-GXDHUFHOSA-N Google Search
Mol Weight	361.38 g/mol
Molecular Formula	C17H20FN5O3
Exact Mass	361.155018 g/mol

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SpectraBase Spectrum ID	INnWaqIWyzl
Name	(5E)-1-(4-fluorobenzyl)-5-{[(4-methyl-1-piperazinyl)amino]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/C17H20FN5O3/c1-21-6-8-22(9-7-21)19-10-14-15(24)20-17(26)23(16(14)25)11-12-2-4-13(18)5-3-12/h2-5,10,19H,6-9,11H2,1H3,(H,20,24,26)/b14-10+
InChIKey	BAVPSNHVLTVZKX-GXDHUFHOSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_17594
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: D28717; Labnumber: KKA-0211-1852; SBI_ID: SBI-017597
Synonyms	1-(4-fluorobenzyl)-5-{[(4-methyl-1-piperazinyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature	308 °C