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acetamide, N-(2,3-dimethylphenyl)-2-[[3,4,5,6,7,8-hexahydro-6-[(4-methylphenyl)methyl]-4-oxopyrido[4,3-d]pyrimidin-2-yl]thio]-

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acetamide, N-(2,3-dimethylphenyl)-2-[[3,4,5,6,7,8-hexahydro-6-[(4-methylphenyl)methyl]-4-oxopyrido[4,3-d]pyrimidin-2-yl]thio]-
SpectraBase Compound ID 4vGAsIhB4ds
InChI InChI=1S/C25H28N4O2S/c1-16-7-9-19(10-8-16)13-29-12-11-22-20(14-29)24(31)28-25(27-22)32-15-23(30)26-21-6-4-5-17(2)18(21)3/h4-10H,11-15H2,1-3H3,(H,26,30)(H,27,28,31)
InChIKey KSOPTQQTIBHVAY-UHFFFAOYSA-N
Mol Weight 448.59 g/mol
Molecular Formula C25H28N4O2S
Exact Mass 448.193297 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID C580YQe7HMQ
Name acetamide, N-(2,3-dimethylphenyl)-2-[[3,4,5,6,7,8-hexahydro-6-[(4-methylphenyl)methyl]-4-oxopyrido[4,3-d]pyrimidin-2-yl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 448.193297330 u
Formula C25H28N4O2S
InChI InChI=1S/C25H28N4O2S/c1-16-7-9-19(10-8-16)13-29-12-11-22-20(14-29)24(31)28-25(27-22)32-15-23(30)26-21-6-4-5-17(2)18(21)3/h4-10H,11-15H2,1-3H3,(H,26,30)(H,27,28,31)
InChIKey KSOPTQQTIBHVAY-UHFFFAOYSA-N
Molecular Weight 448.585 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_8858
Solvent DMSO-d6
Source Vendor ID: NMR/13309684