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(5Z)-2-[4-(2-methylphenyl)-1-piperazinyl]-5-[(3-phenyl-1H-pyrazol-4-yl)methylene]-1,3-thiazol-4(5H)-one
SpectraBase Compound ID 9aQF1oZJLSv
InChI InChI=1S/C24H23N5OS/c1-17-7-5-6-10-20(17)28-11-13-29(14-12-28)24-26-23(30)21(31-24)15-19-16-25-27-22(19)18-8-3-2-4-9-18/h2-10,15-16H,11-14H2,1H3,(H,25,27)/b21-15-
InChIKey BGJZUKQPXNZDLQ-QNGOZBTKSA-N
Mol Weight 429.54 g/mol
Molecular Formula C24H23N5OS
Exact Mass 429.162332 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DUTtL3Yai3E
Name (5Z)-2-[4-(2-Methylphenyl)-1-piperazinyl]-5-[(3-phenyl-1H-pyrazol-4-yl)methylene]-1,3-thiazol-4(5H)-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 429.162331554 u
Formula C24H23N5OS
InChI InChI=1S/C24H23N5OS/c1-17-7-5-6-10-20(17)28-11-13-29(14-12-28)24-26-23(30)21(31-24)15-19-16-25-27-22(19)18-8-3-2-4-9-18/h2-10,15-16H,11-14H2,1H3,(H,25,27)/b21-15-
InChIKey BGJZUKQPXNZDLQ-QNGOZBTKSA-N
Molecular Weight 429.542 g/mol
SMILES N1N=C(C(=C1)\C=C\1C(N=C(S1)N1CCN(CC1)C1=C(C)C=CC=C1)=O)C=1C=CC=CC1