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(5Z)-5-(2-propoxybenzylidene)-2-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1,3-thiazol-4(5H)-one
SpectraBase Compound ID CNnUCMIEqLS
InChI InChI=1S/C24H24F3N3O2S/c1-2-14-32-20-9-4-3-6-17(20)15-21-22(31)28-23(33-21)30-12-10-29(11-13-30)19-8-5-7-18(16-19)24(25,26)27/h3-9,15-16H,2,10-14H2,1H3/b21-15-
InChIKey YWJIIZYDESHXDM-QNGOZBTKSA-N
Mol Weight 475.53 g/mol
Molecular Formula C24H24F3N3O2S
Exact Mass 475.154133 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5VcwIkHtY4x
Name (5Z)-5-(2-Propoxybenzylidene)-2-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1,3-thiazol-4(5H)-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 475.154132686 u
Formula C24H24F3N3O2S
InChI InChI=1S/C24H24F3N3O2S/c1-2-14-32-20-9-4-3-6-17(20)15-21-22(31)28-23(33-21)30-12-10-29(11-13-30)19-8-5-7-18(16-19)24(25,26)27/h3-9,15-16H,2,10-14H2,1H3/b21-15-
InChIKey YWJIIZYDESHXDM-QNGOZBTKSA-N
Molecular Weight 475.530 g/mol
SMILES C=1C=CC(\C=C\2C(N=C(S2)N2CCN(CC2)C2=CC(C(F)(F)F)=CC=C2)=O)=C(OCCC)C1