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3-thiazolidineacetamide, 5-[(2,3-dimethoxyphenyl)methylene]-N-[2-(4-hydroxyphenyl)ethyl]-2,4-dioxo-, (5Z)-
SpectraBase Compound ID 52ZltAwi2yJ
InChI InChI=1S/C22H22N2O6S/c1-29-17-5-3-4-15(20(17)30-2)12-18-21(27)24(22(28)31-18)13-19(26)23-11-10-14-6-8-16(25)9-7-14/h3-9,12,25H,10-11,13H2,1-2H3,(H,23,26)/b18-12-
InChIKey AZWIMQFYFQKYHN-PDGQHHTCSA-N
Mol Weight 442.49 g/mol
Molecular Formula C22H22N2O6S
Exact Mass 442.119858 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ARAgGWxRI0F
Name 3-Thiazolidineacetamide, 5-[(2,3-dimethoxyphenyl)methylene]-N-[2-(4-hydroxyphenyl)ethyl]-2,4-dioxo-, (5Z)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 442.119857604 u
Formula C22H22N2O6S
InChI InChI=1S/C22H22N2O6S/c1-29-17-5-3-4-15(20(17)30-2)12-18-21(27)24(22(28)31-18)13-19(26)23-11-10-14-6-8-16(25)9-7-14/h3-9,12,25H,10-11,13H2,1-2H3,(H,23,26)/b18-12-
InChIKey AZWIMQFYFQKYHN-PDGQHHTCSA-N
Molecular Weight 442.486 g/mol
SMILES N(C(CN1C(S\C(C1=O)=C\C=1C(=C(OC)C=CC1)OC)=O)=O)CCC1=CC=C(C=C1)O