(5Z)-1-(3-methylphenyl)-5-[(5-nitro-2-furyl)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

SpectraBase Compound ID	4KlksYGTexa
InChI	InChI=1S/C16H11N3O5S/c1-9-3-2-4-10(7-9)18-15(21)12(14(20)17-16(18)25)8-11-5-6-13(24-11)19(22)23/h2-8H,1H3,(H,17,20,25)/b12-8-
InChIKey	UWRHXMWUQJIUCZ-WQLSENKSSA-N Google Search
Mol Weight	357.34 g/mol
Molecular Formula	C16H11N3O5S
Exact Mass	357.041942 g/mol

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SpectraBase Spectrum ID	D469HJ5Grjq
Name	(5Z)-1-(3-methylphenyl)-5-[(5-nitro-2-furyl)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
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/C16H11N3O5S/c1-9-3-2-4-10(7-9)18-15(21)12(14(20)17-16(18)25)8-11-5-6-13(24-11)19(22)23/h2-8H,1H3,(H,17,20,25)/b12-8-
InChIKey	UWRHXMWUQJIUCZ-WQLSENKSSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_7104
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: 124049; Labnumber: KKA002-0000097; VK_ID: VK-007108
Synonyms	1-(3-methylphenyl)-5-[(5-nitro-2-furyl)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature	308 °C