(5E)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylene}-1-(3,4-dimethylphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione

SpectraBase Compound ID	Juocg2ejK9m
InChI	InChI=1S/C21H19N3O5/c1-12-3-5-15(7-13(12)2)24-20(26)16(19(25)23-21(24)27)10-22-9-14-4-6-17-18(8-14)29-11-28-17/h3-8,10,22H,9,11H2,1-2H3,(H,23,25,27)/b16-10+
InChIKey	GUEPIWDKJAEBFE-MHWRWJLKSA-N Google Search
Mol Weight	393.4 g/mol
Molecular Formula	C21H19N3O5
Exact Mass	393.132471 g/mol

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SpectraBase Spectrum ID	DHCuw6OsXGa
Name	(5E)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylene}-1-(3,4-dimethylphenyl)-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/C21H19N3O5/c1-12-3-5-15(7-13(12)2)24-20(26)16(19(25)23-21(24)27)10-22-9-14-4-6-17-18(8-14)29-11-28-17/h3-8,10,22H,9,11H2,1-2H3,(H,23,25,27)/b16-10+
InChIKey	GUEPIWDKJAEBFE-MHWRWJLKSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_17641
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: D28844; Labnumber: KKA-0211-3761; SBI_ID: SBI-017644
Synonyms	5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylene}-1-(3,4-dimethylphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature	318 °C