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N'-[(E)-(4-methoxyphenyl)methylidene]-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}acetohydrazide
SpectraBase Compound ID K7m3eNFdhrS
InChI InChI=1S/C25H22N4O4S/c1-32-19-11-7-17(8-12-19)15-26-28-23(30)16-34-25-27-22-6-4-3-5-21(22)24(31)29(25)18-9-13-20(33-2)14-10-18/h3-15H,16H2,1-2H3,(H,28,30)/b26-15+
InChIKey SRQWCVBQYYCROR-CVKSISIWSA-N
Mol Weight 474.54 g/mol
Molecular Formula C25H22N4O4S
Exact Mass 474.136176 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HwuwxwENSN8
Name N'-[(E)-(4-methoxyphenyl)methylidene]-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}acetohydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 474.136176374 u
Formula C25H22N4O4S
InChI InChI=1S/C25H22N4O4S/c1-32-19-11-7-17(8-12-19)15-26-28-23(30)16-34-25-27-22-6-4-3-5-21(22)24(31)29(25)18-9-13-20(33-2)14-10-18/h3-15H,16H2,1-2H3,(H,28,30)/b26-15+
InChIKey SRQWCVBQYYCROR-CVKSISIWSA-N
Molecular Weight 474.535 g/mol
SMILES N(\N=C\C1=CC=C(C=C1)OC)C(CSC=1N(C(C=2C(=CC=CC2)N1)=O)C1=CC=C(C=C1)OC)=O