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2-{[[3-(biphenyl-4-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]-hydra-zono}-4-phenyl-2,3-dihydrothiazole

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2-{[[3-(biphenyl-4-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]-hydra-zono}-4-phenyl-2,3-dihydrothiazole
SpectraBase Compound ID KZFDqSQlBFh
InChI InChI=1S/C31H23N5S/c1-4-10-23(11-5-1)24-16-18-26(19-17-24)30-27(21-36(35-30)28-14-8-3-9-15-28)20-32-34-31-33-29(22-37-31)25-12-6-2-7-13-25/h1-22H,(H,33,34)/b32-20+
InChIKey WIJSCLFFNPGUAQ-UZWMFBFFSA-N
Mol Weight 497.62 g/mol
Molecular Formula C31H23N5S
Exact Mass 497.167417 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F5v8aScCZ9j
Name 2-{[[3-(biphenyl-4-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]-hydra-zono}-4-phenyl-2,3-dihydrothiazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 497.167416935 u
Formula C31H23N5S
InChI InChI=1S/C31H23N5S/c1-4-10-23(11-5-1)24-16-18-26(19-17-24)30-27(21-36(35-30)28-14-8-3-9-15-28)20-32-34-31-33-29(22-37-31)25-12-6-2-7-13-25/h1-22H,(H,33,34)/b32-20+
InChIKey WIJSCLFFNPGUAQ-UZWMFBFFSA-N
Molecular Weight 497.620 g/mol
SMILES C=1N(N=C(C1\C=N\N=C\1NC(C=2C=CC=CC2)=CS1)C=1C=CC(=CC1)C=1C=CC=CC1)C1=CC=CC=C1