(5E)-5-({[3-(dimethylamino)propyl]amino}methylene)-1-(2-methoxyphenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

SpectraBase Compound ID	C8gmEmLAq7a
InChI	InChI=1S/C17H22N4O3S/c1-20(2)10-6-9-18-11-12-15(22)19-17(25)21(16(12)23)13-7-4-5-8-14(13)24-3/h4-5,7-8,11,18H,6,9-10H2,1-3H3,(H,19,22,25)/b12-11+
InChIKey	QMJVBAGINOFRGG-VAWYXSNFSA-N Google Search
Mol Weight	362.45 g/mol
Molecular Formula	C17H22N4O3S
Exact Mass	362.141262 g/mol

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SpectraBase Spectrum ID	FShp55JXuh1
Name	(5E)-5-({[3-(dimethylamino)propyl]amino}methylene)-1-(2-methoxyphenyl)-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/C17H22N4O3S/c1-20(2)10-6-9-18-11-12-15(22)19-17(25)21(16(12)23)13-7-4-5-8-14(13)24-3/h4-5,7-8,11,18H,6,9-10H2,1-3H3,(H,19,22,25)/b12-11+
InChIKey	QMJVBAGINOFRGG-VAWYXSNFSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_15815
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: C74689; Labnumber: KKA-9909-11725; SBI_ID: SBI-015818
Synonyms	5-({[3-(dimethylamino)propyl]amino}methylene)-1-(2-methoxyphenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature	308 °C