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3-thiazolidinepropanamide, 5-[(3,4-dimethoxyphenyl)methylene]-4-oxo-N-(2-thiazolyl)-2-thioxo-, (5Z)-
SpectraBase Compound ID 7J6WhO5Pkc3
InChI InChI=1S/C18H17N3O4S3/c1-24-12-4-3-11(9-13(12)25-2)10-14-16(23)21(18(26)28-14)7-5-15(22)20-17-19-6-8-27-17/h3-4,6,8-10H,5,7H2,1-2H3,(H,19,20,22)/b14-10-
InChIKey CXGCBMCZTBIVCY-UVTDQMKNSA-N
Mol Weight 435.53 g/mol
Molecular Formula C18H17N3O4S3
Exact Mass 435.03812 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID hvTw3FyjYU
Name 3-Thiazolidinepropanamide, 5-[(3,4-dimethoxyphenyl)methylene]-4-oxo-N-(2-thiazolyl)-2-thioxo-, (5Z)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 435.038119557 u
Formula C18H17N3O4S3
InChI InChI=1S/C18H17N3O4S3/c1-24-12-4-3-11(9-13(12)25-2)10-14-16(23)21(18(26)28-14)7-5-15(22)20-17-19-6-8-27-17/h3-4,6,8-10H,5,7H2,1-2H3,(H,19,20,22)/b14-10-
InChIKey CXGCBMCZTBIVCY-UVTDQMKNSA-N
Molecular Weight 435.531 g/mol
SMILES N(C1=NC=CS1)C(CCN1C(S\C(C1=O)=C\C=1C=C(OC)C(=CC1)OC)=S)=O