(5E)-1-(4-chlorophenyl)-5-(1-{[3-(1-piperidinyl)propyl]amino}ethylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione

SpectraBase Compound ID	LYKgrbGiogR
InChI	InChI=1S/C20H25ClN4O3/c1-14(22-10-5-13-24-11-3-2-4-12-24)17-18(26)23-20(28)25(19(17)27)16-8-6-15(21)7-9-16/h6-9,22H,2-5,10-13H2,1H3,(H,23,26,28)/b17-14+
InChIKey	SZCPQFGWOCGYCP-SAPNQHFASA-N Google Search
Mol Weight	404.9 g/mol
Molecular Formula	C20H25ClN4O3
Exact Mass	404.161518 g/mol

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SpectraBase Spectrum ID	Iv9pcijqoec
Name	(5E)-1-(4-chlorophenyl)-5-(1-{[3-(1-piperidinyl)propyl]amino}ethylidene)-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/C20H25ClN4O3/c1-14(22-10-5-13-24-11-3-2-4-12-24)17-18(26)23-20(28)25(19(17)27)16-8-6-15(21)7-9-16/h6-9,22H,2-5,10-13H2,1H3,(H,23,26,28)/b17-14+
InChIKey	SZCPQFGWOCGYCP-SAPNQHFASA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_29114
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: D90979; Labnumber: KKA-0212A-0486; SBI_ID: SBI-029118
Synonyms	1-(4-chlorophenyl)-5-(1-{[3-(1-piperidinyl)propyl]amino}ethylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature	318 °C