benzoic acid, 4-chloro-, 4-(3,4,5,6,7,8-hexahydro-4-oxobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)-2-methoxyphenyl ester

SpectraBase Compound ID	Kq8teNAdbec
InChI	InChI=1S/C24H19ClN2O4S/c1-30-18-12-14(8-11-17(18)31-24(29)13-6-9-15(25)10-7-13)21-26-22(28)20-16-4-2-3-5-19(16)32-23(20)27-21/h6-12H,2-5H2,1H3,(H,26,27,28)
InChIKey	OQCHFGBFMKLPFL-UHFFFAOYSA-N Google Search
Mol Weight	466.94 g/mol
Molecular Formula	C24H19ClN2O4S
Exact Mass	466.075406 g/mol

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SpectraBase Spectrum ID	LdkaVAPwmOe
Name	benzoic acid, 4-chloro-, 4-(3,4,5,6,7,8-hexahydro-4-oxobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)-2-methoxyphenyl 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/C24H19ClN2O4S/c1-30-18-12-14(8-11-17(18)31-24(29)13-6-9-15(25)10-7-13)21-26-22(28)20-16-4-2-3-5-19(16)32-23(20)27-21/h6-12H,2-5H2,1H3,(H,26,27,28)
InChIKey	OQCHFGBFMKLPFL-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB3_9000_2475
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/11269126