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3-Biphenyl-4-yl-1H-pyrazole-4-carbaldehyde[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]hydrazone
SpectraBase Compound ID APoINWhsLPh
InChI InChI=1S/C25H17Cl2N5S/c26-20-10-11-21(22(27)12-20)23-15-33-25(30-23)32-29-14-19-13-28-31-24(19)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-15H,(H,28,31)(H,30,32)/b29-14+
InChIKey BVVMMANCRRUIOY-IPPBACCNSA-N
Mol Weight 490.41 g/mol
Molecular Formula C25H17Cl2N5S
Exact Mass 489.058172 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3FlWCNTX5Ol
Name 3-Biphenyl-4-yl-1H-pyrazole-4-carbaldehyde[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]hydrazone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 489.058172141 u
Formula C25H17Cl2N5S
InChI InChI=1S/C25H17Cl2N5S/c26-20-10-11-21(22(27)12-20)23-15-33-25(30-23)32-29-14-19-13-28-31-24(19)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-15H,(H,28,31)(H,30,32)/b29-14+
InChIKey BVVMMANCRRUIOY-IPPBACCNSA-N
Molecular Weight 490.412 g/mol
SMILES C=1(N=C(SC1)N\N=C\C=1C(=NNC1)C1=CC=C(C=C1)C1=CC=CC=C1)C=1C(=CC(=CC1)Cl)Cl