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3-thiophenecarboxylic acid, 5-phenyl-2-[[[(5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-, methyl ester

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3-thiophenecarboxylic acid, 5-phenyl-2-[[[(5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-, methyl ester
SpectraBase Compound ID GTjAXcSo8bs
InChI InChI=1S/C24H21N3O3S3/c1-30-24(29)16-11-18(14-7-3-2-4-8-14)33-21(16)27-19(28)12-31-22-20-15-9-5-6-10-17(15)32-23(20)26-13-25-22/h2-4,7-8,11,13H,5-6,9-10,12H2,1H3,(H,27,28)
InChIKey NXEKPYLWBOGYCZ-UHFFFAOYSA-N
Mol Weight 495.63 g/mol
Molecular Formula C24H21N3O3S3
Exact Mass 495.074505 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L5RFUvDM1WD
Name 3-thiophenecarboxylic acid, 5-phenyl-2-[[[(5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-, 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/C24H21N3O3S3/c1-30-24(29)16-11-18(14-7-3-2-4-8-14)33-21(16)27-19(28)12-31-22-20-15-9-5-6-10-17(15)32-23(20)26-13-25-22/h2-4,7-8,11,13H,5-6,9-10,12H2,1H3,(H,27,28)
InChIKey NXEKPYLWBOGYCZ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_1014
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/11228733