(5E)-1-(4-bromophenyl)-5-[4-(methylsulfanyl)benzylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione

SpectraBase Compound ID	AUjUhzqOwt5
InChI	InChI=1S/C18H13BrN2O3S/c1-25-14-8-2-11(3-9-14)10-15-16(22)20-18(24)21(17(15)23)13-6-4-12(19)5-7-13/h2-10H,1H3,(H,20,22,24)/b15-10+
InChIKey	ZOGREBPWICYTEH-XNTDXEJSSA-N Google Search
Mol Weight	417.28 g/mol
Molecular Formula	C18H13BrN2O3S
Exact Mass	415.983026 g/mol

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SpectraBase Spectrum ID	JnXUszuyA9r
Name	(5E)-1-(4-bromophenyl)-5-[4-(methylsulfanyl)benzylidene]-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/C18H13BrN2O3S/c1-25-14-8-2-11(3-9-14)10-15-16(22)20-18(24)21(17(15)23)13-6-4-12(19)5-7-13/h2-10H,1H3,(H,20,22,24)/b15-10+
InChIKey	ZOGREBPWICYTEH-XNTDXEJSSA-N
NMR Offset	17.5285
NMR Spectrometer Frequency	500.138
Observed nucleus	1H
Origin	1H_UBI_21270_14078
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: UZI/1010711; UBI_ID: UBI-014081
Synonyms	1-(4-bromophenyl)-5-[4-(methylsulfanyl)benzylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature	300 °C