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methyl 6-methyl-4-{2-[2-oxo-2-(2-toluidino)ethoxy]phenyl}-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID J2iyYRNBiEg
InChI InChI=1S/C22H23N3O4S/c1-13-8-4-6-10-16(13)24-18(26)12-29-17-11-7-5-9-15(17)20-19(21(27)28-3)14(2)23-22(30)25-20/h4-11,20H,12H2,1-3H3,(H,24,26)(H2,23,25,30)
InChIKey KATPDVDZEZMYHX-UHFFFAOYSA-N
Mol Weight 425.5 g/mol
Molecular Formula C22H23N3O4S
Exact Mass 425.140927 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID XHVZbpRW5H
Name methyl 6-methyl-4-{2-[2-oxo-2-(2-toluidino)ethoxy]phenyl}-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/C22H23N3O4S/c1-13-8-4-6-10-16(13)24-18(26)12-29-17-11-7-5-9-15(17)20-19(21(27)28-3)14(2)23-22(30)25-20/h4-11,20H,12H2,1-3H3,(H,24,26)(H2,23,25,30)
InChIKey KATPDVDZEZMYHX-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34824
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: 9559854; SBI_ID: SBI-034828
Temperature 318 °C