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1H-Imidazole-4-acetamide, 3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-ethoxyphenyl)tetrahydro-5-oxo-N-phenyl-2-thioxo-
SpectraBase Compound ID 8ty4bYDmfoL
InChI InChI=1S/C29H31N3O5S/c1-4-37-23-13-11-22(12-14-23)32-28(34)24(19-27(33)30-21-8-6-5-7-9-21)31(29(32)38)17-16-20-10-15-25(35-2)26(18-20)36-3/h5-15,18,24H,4,16-17,19H2,1-3H3,(H,30,33)
InChIKey YSMBANQSZDCXQI-UHFFFAOYSA-N
Mol Weight 533.64 g/mol
Molecular Formula C29H31N3O5S
Exact Mass 533.198442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lw2adQkTgqI
Name 1H-Imidazole-4-acetamide, 3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-ethoxyphenyl)tetrahydro-5-oxo-N-phenyl-2-thioxo-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H31N3O5S
InChI InChI=1S/C29H31N3O5S/c1-4-37-23-13-11-22(12-14-23)32-28(34)24(19-27(33)30-21-8-6-5-7-9-21)31(29(32)38)17-16-20-10-15-25(35-2)26(18-20)36-3/h5-15,18,24H,4,16-17,19H2,1-3H3,(H,30,33)
InChIKey YSMBANQSZDCXQI-UHFFFAOYSA-N
Molecular Weight 533.643 g/mol
SMILES N(C(CC1C(N(C(N1CCc1cc(OC)c(cc1)OC)=S)c1ccc(cc1)OCC)=O)=O)c1ccccc1
SPLASH splash10-03di-0900000000-a4149db49bcf4b372452
Source of Spectrum IY-1-4687-1
Synonyms 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-ethoxyphenyl)-5-oxo-2-sulfanylidene-4-imidazolidinyl]-N-phenylacetamide 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-ethoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-phenylacetamide 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-ethoxyphenyl)-5-oxo-2-thioxo-imidazolidin-4-yl]-N-phenyl-acetamide 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-ethoxyphenyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]-N-phenyl-ethanamide
Wiley ID 1654854