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3-thiazolidineacetamide, 4-oxo-N-(2-pyridinyl)-2-thioxo-5-[(3,4,5-trimethoxyphenyl)methylene]-, (5Z)-

View entire compound with spectra: 2 NMR

3-thiazolidineacetamide, 4-oxo-N-(2-pyridinyl)-2-thioxo-5-[(3,4,5-trimethoxyphenyl)methylene]-, (5Z)-
SpectraBase Compound ID H5jPWN4S1Z9
InChI InChI=1S/C20H19N3O5S2/c1-26-13-8-12(9-14(27-2)18(13)28-3)10-15-19(25)23(20(29)30-15)11-17(24)22-16-6-4-5-7-21-16/h4-10H,11H2,1-3H3,(H,21,22,24)/b15-10-
InChIKey LCVIWWHFWPQXPO-GDNBJRDFSA-N
Mol Weight 445.51 g/mol
Molecular Formula C20H19N3O5S2
Exact Mass 445.076613 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GDkdvBvAt82
Name 3-Thiazolidineacetamide, 4-oxo-N-(2-pyridinyl)-2-thioxo-5-[(3,4,5-trimethoxyphenyl)methylene]-, (5Z)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 445.076613067 u
Formula C20H19N3O5S2
InChI InChI=1S/C20H19N3O5S2/c1-26-13-8-12(9-14(27-2)18(13)28-3)10-15-19(25)23(20(29)30-15)11-17(24)22-16-6-4-5-7-21-16/h4-10H,11H2,1-3H3,(H,21,22,24)/b15-10-
InChIKey LCVIWWHFWPQXPO-GDNBJRDFSA-N
Molecular Weight 445.508 g/mol
SMILES N(C(CN1C(S\C(C1=O)=C\C1=CC(OC)=C(C(=C1)OC)OC)=S)=O)C1=NC=CC=C1