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(5E)-2-(4-benzyl-1-piperazinyl)-5-(4-ethoxybenzylidene)-1,3-thiazol-4(5H)-one

View entire compound with spectra: 2 NMR

(5E)-2-(4-benzyl-1-piperazinyl)-5-(4-ethoxybenzylidene)-1,3-thiazol-4(5H)-one
SpectraBase Compound ID HHYGbEuyB4X
InChI InChI=1S/C23H25N3O2S/c1-2-28-20-10-8-18(9-11-20)16-21-22(27)24-23(29-21)26-14-12-25(13-15-26)17-19-6-4-3-5-7-19/h3-11,16H,2,12-15,17H2,1H3/b21-16+
InChIKey LMLCXGUMHVTMFU-LTGZKZEYSA-N
Mol Weight 407.53 g/mol
Molecular Formula C23H25N3O2S
Exact Mass 407.166748 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AQ8ayhr7hlG
Name (5E)-2-(4-Benzyl-1-piperazinyl)-5-(4-ethoxybenzylidene)-1,3-thiazol-4(5H)-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 407.166748229 u
Formula C23H25N3O2S
InChI InChI=1S/C23H25N3O2S/c1-2-28-20-10-8-18(9-11-20)16-21-22(27)24-23(29-21)26-14-12-25(13-15-26)17-19-6-4-3-5-7-19/h3-11,16H,2,12-15,17H2,1H3/b21-16+
InChIKey LMLCXGUMHVTMFU-LTGZKZEYSA-N
Molecular Weight 407.532 g/mol
SMILES C=1C=CC(CN2CCN(C3=NC(\C(=C/C4=CC=C(C=C4)OCC)S3)=O)CC2)=CC1