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4-[(1E)-N-({[3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}acetyl)ethanehydrazonoyl]phenyl acetate
SpectraBase Compound ID Jjh7J6ugej5
InChI InChI=1S/C26H21ClN4O4S/c1-16(18-7-13-21(14-8-18)35-17(2)32)29-30-24(33)15-36-26-28-23-6-4-3-5-22(23)25(34)31(26)20-11-9-19(27)10-12-20/h3-14H,15H2,1-2H3,(H,30,33)/b29-16+
InChIKey QYDHAPULRBYCJU-MUFRIFMGSA-N
Mol Weight 520.99 g/mol
Molecular Formula C26H21ClN4O4S
Exact Mass 520.097204 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HRHNFEXPjrJ
Name 4-[(1E)-N-({[3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}acetyl)ethanehydrazonoyl]phenyl acetate
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/C26H21ClN4O4S/c1-16(18-7-13-21(14-8-18)35-17(2)32)29-30-24(33)15-36-26-28-23-6-4-3-5-22(23)25(34)31(26)20-11-9-19(27)10-12-20/h3-14H,15H2,1-2H3,(H,30,33)/b29-16+
InChIKey QYDHAPULRBYCJU-MUFRIFMGSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17016
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: D24753; Labnumber: GRES-02754; SBI_ID: SBI-017019
Synonyms 4-[N-({[3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}acetyl)ethanehydrazonoyl]phenyl acetate
Temperature 308 °C