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2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N'-[(E)-1-(3-methoxyphenyl)ethylidene]acetohydrazide
SpectraBase Compound ID zW73QzHBrA
InChI InChI=1S/C25H21ClN4O3S/c1-16(17-6-5-7-20(14-17)33-2)28-29-23(31)15-34-25-27-22-9-4-3-8-21(22)24(32)30(25)19-12-10-18(26)11-13-19/h3-14H,15H2,1-2H3,(H,29,31)/b28-16+
InChIKey LLYJYKUGDKDLCA-LQKURTRISA-N
Mol Weight 492.98 g/mol
Molecular Formula C25H21ClN4O3S
Exact Mass 492.102289 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8msHaARh3jj
Name 2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N'-[(E)-1-(3-methoxyphenyl)ethylidene]acetohydrazide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H21ClN4O3S/c1-16(17-6-5-7-20(14-17)33-2)28-29-23(31)15-34-25-27-22-9-4-3-8-21(22)24(32)30(25)19-12-10-18(26)11-13-19/h3-14H,15H2,1-2H3,(H,29,31)/b28-16+
InChIKey LLYJYKUGDKDLCA-LQKURTRISA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17013
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D24747; Labnumber: GRES-02748; SBI_ID: SBI-017016
Synonyms 2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N'-[1-(3-methoxyphenyl)ethylidene]acetohydrazide
Temperature 308 °C