(5E)-1-(4-methoxybenzyl)-5-[(5-nitro-2-thienyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione

SpectraBase Compound ID	DRMLiojeEm7
InChI	InChI=1S/C17H13N3O6S/c1-26-11-4-2-10(3-5-11)9-19-16(22)13(15(21)18-17(19)23)8-12-6-7-14(27-12)20(24)25/h2-8H,9H2,1H3,(H,18,21,23)/b13-8+
InChIKey	WTRNVEKJBPADMF-MDWZMJQESA-N Google Search
Mol Weight	387.37 g/mol
Molecular Formula	C17H13N3O6S
Exact Mass	387.052506 g/mol

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SpectraBase Spectrum ID	3HBawu5fzMt
Name	(5E)-1-(4-methoxybenzyl)-5-[(5-nitro-2-thienyl)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/C17H13N3O6S/c1-26-11-4-2-10(3-5-11)9-19-16(22)13(15(21)18-17(19)23)8-12-6-7-14(27-12)20(24)25/h2-8H,9H2,1H3,(H,18,21,23)/b13-8+
InChIKey	WTRNVEKJBPADMF-MDWZMJQESA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_5295
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: NMR/10321712; Labnumber: LP-1708202; IOH_ID: IOH-005296
Synonyms	1-(4-methoxybenzyl)-5-[(5-nitro-2-thienyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione