1,3-benzenedicarboxylic acid, 5-[[[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-, diethyl ester

SpectraBase Compound ID	EJrG5R36qvw
InChI	InChI=1S/C22H23N3O5S2/c1-5-29-21(27)14-7-15(22(28)30-6-2)9-16(8-14)25-17(26)10-31-19-18-12(3)13(4)32-20(18)24-11-23-19/h7-9,11H,5-6,10H2,1-4H3,(H,25,26)
InChIKey	COPSVTSKPBYOKF-UHFFFAOYSA-N Google Search
Mol Weight	473.56 g/mol
Molecular Formula	C22H23N3O5S2
Exact Mass	473.107913 g/mol

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SpectraBase Spectrum ID	9nXaTIOHKa9
Name	1,3-benzenedicarboxylic acid, 5-[[[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-, diethyl 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/C22H23N3O5S2/c1-5-29-21(27)14-7-15(22(28)30-6-2)9-16(8-14)25-17(26)10-31-19-18-12(3)13(4)32-20(18)24-11-23-19/h7-9,11H,5-6,10H2,1-4H3,(H,25,26)
InChIKey	COPSVTSKPBYOKF-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_3517_992
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/11228710