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4-thiazolidinone, 3-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-5-(phenylmethylene)-2-thioxo-, (5E)-
SpectraBase Compound ID G0bMuNjEp3c
InChI InChI=1S/C23H23N3O2S2/c27-21(25-13-11-24(12-14-25)16-19-9-5-2-6-10-19)17-26-22(28)20(30-23(26)29)15-18-7-3-1-4-8-18/h1-10,15H,11-14,16-17H2/b20-15+
InChIKey QBDZVOSUXMHGSJ-HMMYKYKNSA-N
Mol Weight 437.58 g/mol
Molecular Formula C23H23N3O2S2
Exact Mass 437.123169 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4HZyY9iEYx7
Name 4-Thiazolidinone, 3-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-5-(phenylmethylene)-2-thioxo-, (5E)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 437.123169339 u
Formula C23H23N3O2S2
InChI InChI=1S/C23H23N3O2S2/c27-21(25-13-11-24(12-14-25)16-19-9-5-2-6-10-19)17-26-22(28)20(30-23(26)29)15-18-7-3-1-4-8-18/h1-10,15H,11-14,16-17H2/b20-15+
InChIKey QBDZVOSUXMHGSJ-HMMYKYKNSA-N
Molecular Weight 437.576 g/mol
SMILES C=1C=CC(CN2CCN(C(CN3C(S\C(C3=O)=C/C3=CC=CC=C3)=S)=O)CC2)=CC1