(5Z)-1-cyclopropyl-5-[(4-ethoxyanilino)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

SpectraBase Compound ID	9Sr3GBNYITl
InChI	InChI=1S/C16H17N3O3S/c1-2-22-12-7-3-10(4-8-12)17-9-13-14(20)18-16(23)19(15(13)21)11-5-6-11/h3-4,7-9,11,17H,2,5-6H2,1H3,(H,18,20,23)/b13-9-
InChIKey	YAIZUTXBYCUQPJ-LCYFTJDESA-N Google Search
Mol Weight	331.39 g/mol
Molecular Formula	C16H17N3O3S
Exact Mass	331.099063 g/mol

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SpectraBase Spectrum ID	BysFl1vJqE2
Name	(5Z)-1-cyclopropyl-5-[(4-ethoxyanilino)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/C16H17N3O3S/c1-2-22-12-7-3-10(4-8-12)17-9-13-14(20)18-16(23)19(15(13)21)11-5-6-11/h3-4,7-9,11,17H,2,5-6H2,1H3,(H,18,20,23)/b13-9-
InChIKey	YAIZUTXBYCUQPJ-LCYFTJDESA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_27594
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: D77201; Labnumber: KKA-0212C-0917; SBI_ID: SBI-027598
Synonyms	1-cyclopropyl-5-[(4-ethoxyanilino)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature	308 °C