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acetamide, 2-[4-[1-(4,6-dimethyl-2-pyrimidinyl)-4,5,6,7-tetrahydro-3-methyl-6-oxo-1H-pyrazolo[3,4-b]pyridin-4-yl]-2-ethoxyphenoxy]-

View entire compound with spectra: 2 NMR

acetamide, 2-[4-[1-(4,6-dimethyl-2-pyrimidinyl)-4,5,6,7-tetrahydro-3-methyl-6-oxo-1H-pyrazolo[3,4-b]pyridin-4-yl]-2-ethoxyphenoxy]-
SpectraBase Compound ID 1jl7ZHgPpGH
InChI InChI=1S/C23H26N6O4/c1-5-32-18-9-15(6-7-17(18)33-11-19(24)30)16-10-20(31)27-22-21(16)14(4)28-29(22)23-25-12(2)8-13(3)26-23/h6-9,16H,5,10-11H2,1-4H3,(H2,24,30)(H,27,31)
InChIKey KWKGESBKPNVZCJ-UHFFFAOYSA-N
Mol Weight 450.5 g/mol
Molecular Formula C23H26N6O4
Exact Mass 450.201553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9CUNxXVDBDs
Name Acetamide, 2-[4-[1-(4,6-dimethyl-2-pyrimidinyl)-4,5,6,7-tetrahydro-3-methyl-6-oxo-1H-pyrazolo[3,4-B]pyridin-4-yl]-2-ethoxyphenoxy]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 450.201553337 u
Formula C23H26N6O4
InChI InChI=1S/C23H26N6O4/c1-5-32-18-9-15(6-7-17(18)33-11-19(24)30)16-10-20(31)27-22-21(16)14(4)28-29(22)23-25-12(2)8-13(3)26-23/h6-9,16H,5,10-11H2,1-4H3,(H2,24,30)(H,27,31)
InChIKey KWKGESBKPNVZCJ-UHFFFAOYSA-N
Molecular Weight 450.499 g/mol
SMILES N1C(CC(C=2C=CC(OCC(=O)N)=C(C2)OCC)C2=C1N(N=C2C)C1=NC(C)=CC(=N1)C)=O