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

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2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide
SpectraBase Compound ID 97NKA7AMhzE
InChI InChI=1S/C25H19F3N4O3S/c1-35-19-12-10-18(11-13-19)32-23(34)20-4-2-3-5-21(20)30-24(32)36-15-22(33)31-29-14-16-6-8-17(9-7-16)25(26,27)28/h2-14H,15H2,1H3,(H,31,33)/b29-14+
InChIKey GXUYYYMYJVSROP-IPPBACCNSA-N
Mol Weight 512.51 g/mol
Molecular Formula C25H19F3N4O3S
Exact Mass 512.112996 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 86bv2cnOyZ4
Name 2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}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/C25H19F3N4O3S/c1-35-19-12-10-18(11-13-19)32-23(34)20-4-2-3-5-21(20)30-24(32)36-15-22(33)31-29-14-16-6-8-17(9-7-16)25(26,27)28/h2-14H,15H2,1H3,(H,31,33)/b29-14+
InChIKey GXUYYYMYJVSROP-IPPBACCNSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16971
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: D24665; Labnumber: GRES-02662; SBI_ID: SBI-016974
Synonyms 2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N'-{[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide
Temperature 318 °C