benzoic acid, 4-[[[3,4-dihydro-5,6-dimethyl-4-oxo-3-(2-propenyl)thieno[2,3-d]pyrimidin-2-yl]thio]methyl]-, methyl ester

SpectraBase Compound ID	31H0ZxawftA
InChI	InChI=1S/C20H20N2O3S2/c1-5-10-22-18(23)16-12(2)13(3)27-17(16)21-20(22)26-11-14-6-8-15(9-7-14)19(24)25-4/h5-9H,1,10-11H2,2-4H3
InChIKey	FZEZMLHSQXUFFK-UHFFFAOYSA-N Google Search
Mol Weight	400.51 g/mol
Molecular Formula	C20H20N2O3S2
Exact Mass	400.091535 g/mol

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SpectraBase Spectrum ID	AwEASyRhrtg
Name	benzoic acid, 4-[[[3,4-dihydro-5,6-dimethyl-4-oxo-3-(2-propenyl)thieno[2,3-d]pyrimidin-2-yl]thio]methyl]-, methyl ester
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/C20H20N2O3S2/c1-5-10-22-18(23)16-12(2)13(3)27-17(16)21-20(22)26-11-14-6-8-15(9-7-14)19(24)25-4/h5-9H,1,10-11H2,2-4H3
InChIKey	FZEZMLHSQXUFFK-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_6347
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: NMR/10266491