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methyl 4-{3-ethoxy-5-iodo-4-[2-oxo-2-(4-toluidino)ethoxy]phenyl}-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID 4xvDjMK4Kg7
InChI InChI=1S/C24H26IN3O5S/c1-5-32-18-11-15(21-20(23(30)31-4)14(3)26-24(34)28-21)10-17(25)22(18)33-12-19(29)27-16-8-6-13(2)7-9-16/h6-11,21H,5,12H2,1-4H3,(H,27,29)(H2,26,28,34)
InChIKey CJFUCYNRLOWIMK-UHFFFAOYSA-N
Mol Weight 595.45 g/mol
Molecular Formula C24H26IN3O5S
Exact Mass 595.063787 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5N6M6ZTKueZ
Name methyl 4-{3-ethoxy-5-iodo-4-[2-oxo-2-(4-toluidino)ethoxy]phenyl}-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
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/C24H26IN3O5S/c1-5-32-18-11-15(21-20(23(30)31-4)14(3)26-24(34)28-21)10-17(25)22(18)33-12-19(29)27-16-8-6-13(2)7-9-16/h6-11,21H,5,12H2,1-4H3,(H,27,29)(H2,26,28,34)
InChIKey CJFUCYNRLOWIMK-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34816
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: 9510803; SBI_ID: SBI-034820
Temperature 308 °C