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3-thiazolidinepropanamide, 5-[(3,4-dimethoxyphenyl)methylene]-N-(5-methyl-3-isoxazolyl)-4-oxo-2-thioxo-, (5Z)-
SpectraBase Compound ID KGExXWrNE9n
InChI InChI=1S/C19H19N3O5S2/c1-11-8-16(21-27-11)20-17(23)6-7-22-18(24)15(29-19(22)28)10-12-4-5-13(25-2)14(9-12)26-3/h4-5,8-10H,6-7H2,1-3H3,(H,20,21,23)/b15-10-
InChIKey MFKWBNVUSKHJDA-GDNBJRDFSA-N
Mol Weight 433.5 g/mol
Molecular Formula C19H19N3O5S2
Exact Mass 433.076613 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ZZgcBsAsDT
Name 3-Thiazolidinepropanamide, 5-[(3,4-dimethoxyphenyl)methylene]-N-(5-methyl-3-isoxazolyl)-4-oxo-2-thioxo-, (5Z)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 433.076613067 u
Formula C19H19N3O5S2
InChI InChI=1S/C19H19N3O5S2/c1-11-8-16(21-27-11)20-17(23)6-7-22-18(24)15(29-19(22)28)10-12-4-5-13(25-2)14(9-12)26-3/h4-5,8-10H,6-7H2,1-3H3,(H,20,21,23)/b15-10-
InChIKey MFKWBNVUSKHJDA-GDNBJRDFSA-N
Molecular Weight 433.497 g/mol
SMILES N(C1=NOC(=C1)C)C(CCN1C(S\C(C1=O)=C\C=1C=C(OC)C(=CC1)OC)=S)=O