3-thiophenecarboxylic acid, 2-[[[(2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-5-phenyl-, ethyl ester

SpectraBase Compound ID	IFdWtLMqs3G
InChI	InChI=1S/C28H23N3O3S3/c1-3-34-28(33)21-15-23(19-12-8-5-9-13-19)37-27(21)31-24(32)16-35-25-20-14-22(18-10-6-4-7-11-18)36-26(20)30-17(2)29-25/h4-15H,3,16H2,1-2H3,(H,31,32)
InChIKey	IKOFSFWHEDCRNL-UHFFFAOYSA-N Google Search
Mol Weight	545.69 g/mol
Molecular Formula	C28H23N3O3S3
Exact Mass	545.090155 g/mol

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SpectraBase Spectrum ID	awEJ9FhcxD
Name	3-thiophenecarboxylic acid, 2-[[[(2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-5-phenyl-, ethyl 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/C28H23N3O3S3/c1-3-34-28(33)21-15-23(19-12-8-5-9-13-19)37-27(21)31-24(32)16-35-25-20-14-22(18-10-6-4-7-11-18)36-26(20)30-17(2)29-25/h4-15H,3,16H2,1-2H3,(H,31,32)
InChIKey	IKOFSFWHEDCRNL-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_3517_1037
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/11228765