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methyl 4-(2-bromo-4-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethoxy}-5-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

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methyl 4-(2-bromo-4-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethoxy}-5-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID IQFdBOOzp3r
InChI InChI=1S/C25H26BrN3O7S/c1-5-35-23(31)14-6-8-15(9-7-14)28-20(30)12-36-19-11-17(26)16(10-18(19)33-3)22-21(24(32)34-4)13(2)27-25(37)29-22/h6-11,22H,5,12H2,1-4H3,(H,28,30)(H2,27,29,37)
InChIKey YBOPOCDDMGQIAO-UHFFFAOYSA-N
Mol Weight 592.46 g/mol
Molecular Formula C25H26BrN3O7S
Exact Mass 591.067484 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AZxifPdTEd2
Name methyl 4-(2-bromo-4-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethoxy}-5-methoxyphenyl)-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/C25H26BrN3O7S/c1-5-35-23(31)14-6-8-15(9-7-14)28-20(30)12-36-19-11-17(26)16(10-18(19)33-3)22-21(24(32)34-4)13(2)27-25(37)29-22/h6-11,22H,5,12H2,1-4H3,(H,28,30)(H2,27,29,37)
InChIKey YBOPOCDDMGQIAO-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34821
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: 9535936; SBI_ID: SBI-034825
Temperature 308 °C