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4-chlorobenzaldehyde [(2E)-3-benzyl-4-oxo-5-propyl-1,3-thiazolidin-2-ylidene]hydrazone

View entire compound with spectra: 2 NMR

4-chlorobenzaldehyde [(2E)-3-benzyl-4-oxo-5-propyl-1,3-thiazolidin-2-ylidene]hydrazone
SpectraBase Compound ID IX2ZJigQ8p6
InChI InChI=1S/C20H20ClN3OS/c1-2-6-18-19(25)24(14-16-7-4-3-5-8-16)20(26-18)23-22-13-15-9-11-17(21)12-10-15/h3-5,7-13,18H,2,6,14H2,1H3/b22-13+,23-20+
InChIKey OYEFPWLLQYSPRV-GBXVRFTQSA-N
Mol Weight 385.91 g/mol
Molecular Formula C20H20ClN3OS
Exact Mass 385.101561 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3XKDjftrMQv
Name 4-Chlorobenzaldehyde [(2E)-3-benzyl-4-oxo-5-propyl-1,3-thiazolidin-2-ylidene]hydrazone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 385.101561149 u
Formula C20H20ClN3OS
InChI InChI=1S/C20H20ClN3OS/c1-2-6-18-19(25)24(14-16-7-4-3-5-8-16)20(26-18)23-22-13-15-9-11-17(21)12-10-15/h3-5,7-13,18H,2,6,14H2,1H3/b22-13+,23-20+
InChIKey OYEFPWLLQYSPRV-GBXVRFTQSA-N
Molecular Weight 385.913 g/mol
SMILES C=1C=CC(CN2\C(SC(C2=O)CCC)=N/N=C/C=2C=CC(=CC2)Cl)=CC1