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1,3-benzenedicarboxylic acid, 5-[[[[3,4-dihydro-5,6-dimethyl-4-oxo-3-(2-propenyl)thieno[2,3-d]pyrimidin-2-yl]thio]acetyl]amino]-, dimethyl ester

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1,3-benzenedicarboxylic acid, 5-[[[[3,4-dihydro-5,6-dimethyl-4-oxo-3-(2-propenyl)thieno[2,3-d]pyrimidin-2-yl]thio]acetyl]amino]-, dimethyl ester
SpectraBase Compound ID z6duYARWds
InChI InChI=1S/C23H23N3O6S2/c1-6-7-26-20(28)18-12(2)13(3)34-19(18)25-23(26)33-11-17(27)24-16-9-14(21(29)31-4)8-15(10-16)22(30)32-5/h6,8-10H,1,7,11H2,2-5H3,(H,24,27)
InChIKey BGCPTODAXGLKGS-UHFFFAOYSA-N
Mol Weight 501.57 g/mol
Molecular Formula C23H23N3O6S2
Exact Mass 501.102828 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4LSult5eqPD
Name 1,3-benzenedicarboxylic acid, 5-[[[[3,4-dihydro-5,6-dimethyl-4-oxo-3-(2-propenyl)thieno[2,3-d]pyrimidin-2-yl]thio]acetyl]amino]-, dimethyl 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/C23H23N3O6S2/c1-6-7-26-20(28)18-12(2)13(3)34-19(18)25-23(26)33-11-17(27)24-16-9-14(21(29)31-4)8-15(10-16)22(30)32-5/h6,8-10H,1,7,11H2,2-5H3,(H,24,27)
InChIKey BGCPTODAXGLKGS-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_959
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/11228669