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N'-[(E)-(3,4-dichlorophenyl)methylidene]-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}acetohydrazide

View entire compound with spectra: 2 NMR

N'-[(E)-(3,4-dichlorophenyl)methylidene]-2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}acetohydrazide
SpectraBase Compound ID CPcE8AUrewm
InChI InChI=1S/C24H18Cl2N4O3S/c1-33-17-9-7-16(8-10-17)30-23(32)18-4-2-3-5-21(18)28-24(30)34-14-22(31)29-27-13-15-6-11-19(25)20(26)12-15/h2-13H,14H2,1H3,(H,29,31)/b27-13+
InChIKey YUBQLIWCEPTWNE-UVHMKAGCSA-N
Mol Weight 513.4 g/mol
Molecular Formula C24H18Cl2N4O3S
Exact Mass 512.047667 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8N4mveY3ny3
Name N'-[(E)-(3,4-dichlorophenyl)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 512.047667027 u
Formula C24H18Cl2N4O3S
InChI InChI=1S/C24H18Cl2N4O3S/c1-33-17-9-7-16(8-10-17)30-23(32)18-4-2-3-5-21(18)28-24(30)34-14-22(31)29-27-13-15-6-11-19(25)20(26)12-15/h2-13H,14H2,1H3,(H,29,31)/b27-13+
InChIKey YUBQLIWCEPTWNE-UVHMKAGCSA-N
Molecular Weight 513.399 g/mol
SMILES N(\N=C\C=1C=C(Cl)C(=CC1)Cl)C(CSC=1N(C(C=2C(=CC=CC2)N1)=O)C=1C=CC(=CC1)OC)=O