(5E)-1-(2-methylphenyl)-5-[(1-piperidinylamino)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

SpectraBase Compound ID	Le4VQSIBTXj
InChI	InChI=1S/C17H20N4O2S/c1-12-7-3-4-8-14(12)21-16(23)13(15(22)19-17(21)24)11-18-20-9-5-2-6-10-20/h3-4,7-8,11,18H,2,5-6,9-10H2,1H3,(H,19,22,24)/b13-11+
InChIKey	GRIYSBQJJCIHRE-ACCUITESSA-N Google Search
Mol Weight	344.43 g/mol
Molecular Formula	C17H20N4O2S
Exact Mass	344.130697 g/mol

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SpectraBase Spectrum ID	8WIUoPc8fCu
Name	(5E)-1-(2-methylphenyl)-5-[(1-piperidinylamino)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/C17H20N4O2S/c1-12-7-3-4-8-14(12)21-16(23)13(15(22)19-17(21)24)11-18-20-9-5-2-6-10-20/h3-4,7-8,11,18H,2,5-6,9-10H2,1H3,(H,19,22,24)/b13-11+
InChIKey	GRIYSBQJJCIHRE-ACCUITESSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_15812
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: C74681; Labnumber: KKA-9909-11681; SBI_ID: SBI-015815
Synonyms	1-(2-methylphenyl)-5-[(1-piperidinylamino)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature	308 °C