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2-[1-benzyl-3-(3,4-dimethoxybenzyl)-5-oxo-2-thioxo-4-imidazolidinyl]-N-(2,4-dimethylphenyl)acetamide

View entire compound with spectra: 2 NMR

2-[1-benzyl-3-(3,4-dimethoxybenzyl)-5-oxo-2-thioxo-4-imidazolidinyl]-N-(2,4-dimethylphenyl)acetamide
SpectraBase Compound ID 1AxNHXbJ8NK
InChI InChI=1S/C29H31N3O4S/c1-19-10-12-23(20(2)14-19)30-27(33)16-24-28(34)32(17-21-8-6-5-7-9-21)29(37)31(24)18-22-11-13-25(35-3)26(15-22)36-4/h5-15,24H,16-18H2,1-4H3,(H,30,33)
InChIKey JXOKOIDZLBCLCP-UHFFFAOYSA-N
Mol Weight 517.64 g/mol
Molecular Formula C29H31N3O4S
Exact Mass 517.203528 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HiQVWJEC3d6
Name 2-[1-Benzyl-3-(3,4-dimethoxybenzyl)-5-oxo-2-thioxo-4-imidazolidinyl]-N-(2,4-dimethylphenyl)acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 517.203527660 u
Formula C29H31N3O4S
InChI InChI=1S/C29H31N3O4S/c1-19-10-12-23(20(2)14-19)30-27(33)16-24-28(34)32(17-21-8-6-5-7-9-21)29(37)31(24)18-22-11-13-25(35-3)26(15-22)36-4/h5-15,24H,16-18H2,1-4H3,(H,30,33)
InChIKey JXOKOIDZLBCLCP-UHFFFAOYSA-N
Molecular Weight 517.644 g/mol
SMILES N(C(CC1C(N(C(N1CC=1C=C(OC)C(=CC1)OC)=S)CC1=CC=CC=C1)=O)=O)C1=C(C=C(C=C1)C)C