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methyl {2-iodo-6-methoxy-4-[6-methyl-2-thioxo-5-(4-toluidinocarbonyl)-1,2,3,4-tetrahydro-4-pyrimidinyl]phenoxy}acetate
SpectraBase Compound ID BxsgXMvTMis
InChI InChI=1S/C23H24IN3O5S/c1-12-5-7-15(8-6-12)26-22(29)19-13(2)25-23(33)27-20(19)14-9-16(24)21(17(10-14)30-3)32-11-18(28)31-4/h5-10,20H,11H2,1-4H3,(H,26,29)(H2,25,27,33)
InChIKey GYLLSZFROYGFHK-UHFFFAOYSA-N
Mol Weight 581.43 g/mol
Molecular Formula C23H24IN3O5S
Exact Mass 581.048137 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 54vOW2cSQyu
Name methyl {2-iodo-6-methoxy-4-[6-methyl-2-thioxo-5-(4-toluidinocarbonyl)-1,2,3,4-tetrahydro-4-pyrimidinyl]phenoxy}acetate
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/C23H24IN3O5S/c1-12-5-7-15(8-6-12)26-22(29)19-13(2)25-23(33)27-20(19)14-9-16(24)21(17(10-14)30-3)32-11-18(28)31-4/h5-10,20H,11H2,1-4H3,(H,26,29)(H2,25,27,33)
InChIKey GYLLSZFROYGFHK-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31560
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: 1843019; SBI_ID: SBI-031564
Temperature 308 °C