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N-(3,5-dimethoxyphenyl)-N''-(6-{[(4-methylphenyl)sulfanyl]methyl}-4-oxo-1,4-dihydro-2-pyrimidinyl)guanidine
SpectraBase Compound ID 8vTt0adykwS
InChI InChI=1S/C21H23N5O3S/c1-13-4-6-18(7-5-13)30-12-15-10-19(27)25-21(24-15)26-20(22)23-14-8-16(28-2)11-17(9-14)29-3/h4-11H,12H2,1-3H3,(H4,22,23,24,25,26,27)
InChIKey CQQPDBMWVYDXHT-UHFFFAOYSA-N
Mol Weight 425.51 g/mol
Molecular Formula C21H23N5O3S
Exact Mass 425.152161 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1BTBBjoOqY4
Name N-(3,5-dimethoxyphenyl)-N''-(6-{[(4-methylphenyl)sulfanyl]methyl}-4-oxo-1,4-dihydro-2-pyrimidinyl)guanidine
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 425.152160792 u
Formula C21H23N5O3S
InChI InChI=1S/C21H23N5O3S/c1-13-4-6-18(7-5-13)30-12-15-10-19(27)25-21(24-15)26-20(22)23-14-8-16(28-2)11-17(9-14)29-3/h4-11H,12H2,1-3H3,(H4,22,23,24,25,26,27)
InChIKey CQQPDBMWVYDXHT-UHFFFAOYSA-N
Molecular Weight 425.507 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_282
Solvent DMSO-d6
Source Vendor ID: NMR/12259979