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N-(2,5-dichlorophenyl)-2-[(4-{[(4-methylphenyl)sulfanyl]methyl}-6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]acetamide
SpectraBase Compound ID EMruUr354tZ
InChI InChI=1S/C20H17Cl2N3O2S2/c1-12-2-5-15(6-3-12)28-10-14-9-18(26)25-20(23-14)29-11-19(27)24-17-8-13(21)4-7-16(17)22/h2-9H,10-11H2,1H3,(H,24,27)(H,23,25,26)
InChIKey GMXOVSWRMQJDGU-UHFFFAOYSA-N
Mol Weight 466.4 g/mol
Molecular Formula C20H17Cl2N3O2S2
Exact Mass 465.013925 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8aIYDLMpzxU
Name N-(2,5-dichlorophenyl)-2-[(4-{[(4-methylphenyl)sulfanyl]methyl}-6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]acetamide
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/C20H17Cl2N3O2S2/c1-12-2-5-15(6-3-12)28-10-14-9-18(26)25-20(23-14)29-11-19(27)24-17-8-13(21)4-7-16(17)22/h2-9H,10-11H2,1H3,(H,24,27)(H,23,25,26)
InChIKey GMXOVSWRMQJDGU-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_8394
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: 128106; Labnumber: VGU-10764; VK_ID: VK-008398
Temperature 315 °C