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2-{2-[[[3-(biphenyl-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]-hydrazono]-4-phenylthiazol-3(2H)-yl}-N'-(3,4,5-trimethoxybenzyl-idene)acetohydrazide

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-{2-[[[3-(biphenyl-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]-hydrazono]-4-phenylthiazol-3(2H)-yl}-N'-(3,4,5-trimethoxybenzyl-idene)acetohydrazide
SpectraBase Compound ID FV8khaDxLU7
InChI InChI=1S/C43H37N7O4S/c1-52-38-23-30(24-39(53-2)42(38)54-3)25-44-46-40(51)28-49-37(33-15-9-5-10-16-33)29-55-43(49)47-45-26-35-27-50(36-17-11-6-12-18-36)48-41(35)34-21-19-32(20-22-34)31-13-7-4-8-14-31/h4-27,29H,28H2,1-3H3,(H,46,51)/b44-25+,45-26+,47-43+
InChIKey AAFRVJNLKDTPIM-VCKRFHMGSA-N
Mol Weight 747.9 g/mol
Molecular Formula C43H37N7O4S
Exact Mass 747.262774 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IwUne7XJ1bZ
Name 2-{2-[[[3-(biphenyl-3-yl)-1-phenyl-1H-pyrazol-4-yl]methylene]-hydrazono]-4-phenylthiazol-3(2H)-yl}-N'-(3,4,5-trimethoxybenzyl-idene)acetohydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 747.262773869 u
Formula C43H37N7O4S
InChI InChI=1S/C43H37N7O4S/c1-52-38-23-30(24-39(53-2)42(38)54-3)25-44-46-40(51)28-49-37(33-15-9-5-10-16-33)29-55-43(49)47-45-26-35-27-50(36-17-11-6-12-18-36)48-41(35)34-21-19-32(20-22-34)31-13-7-4-8-14-31/h4-27,29H,28H2,1-3H3,(H,46,51)/b44-25+,45-26+,47-43+
InChIKey AAFRVJNLKDTPIM-VCKRFHMGSA-N
Molecular Weight 747.874 g/mol
SMILES C=1N(N=C(C1\C=N\N=C/1N(C(C=2C=CC=CC2)=CS1)CC(N\N=C\C1=CC(OC)=C(C(=C1)OC)OC)=O)C1=CC=C(C=C1)C1=CC=CC=C1)C=1C=CC=CC1