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acetamide, 2-[[1,6-dihydro-4-[[(4-methylphenyl)thio]methyl]-6-oxo-2-pyrimidinyl]thio]-N-(4-methoxyphenyl)-
SpectraBase Compound ID 1fF5W66NQzc
InChI InChI=1S/C21H21N3O3S2/c1-14-3-9-18(10-4-14)28-12-16-11-19(25)24-21(23-16)29-13-20(26)22-15-5-7-17(27-2)8-6-15/h3-11H,12-13H2,1-2H3,(H,22,26)(H,23,24,25)
InChIKey OMWUVJYHYNPOCN-UHFFFAOYSA-N
Mol Weight 427.54 g/mol
Molecular Formula C21H21N3O3S2
Exact Mass 427.102434 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID XomYsAoKoN
Name acetamide, 2-[[1,6-dihydro-4-[[(4-methylphenyl)thio]methyl]-6-oxo-2-pyrimidinyl]thio]-N-(4-methoxyphenyl)-
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/C21H21N3O3S2/c1-14-3-9-18(10-4-14)28-12-16-11-19(25)24-21(23-16)29-13-20(26)22-15-5-7-17(27-2)8-6-15/h3-11H,12-13H2,1-2H3,(H,22,26)(H,23,24,25)
InChIKey OMWUVJYHYNPOCN-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_181
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/11249903