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acetic acid, [[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E,2E)-3-(2-nitrophenyl)-2-propenylidene]hydrazide

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acetic acid, [[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E,2E)-3-(2-nitrophenyl)-2-propenylidene]hydrazide
SpectraBase Compound ID BVxLRbsYqSU
InChI InChI=1S/C25H19ClN6O3S/c26-20-14-12-19(13-15-20)24-29-30-25(31(24)21-9-2-1-3-10-21)36-17-23(33)28-27-16-6-8-18-7-4-5-11-22(18)32(34)35/h1-16H,17H2,(H,28,33)/b8-6+,27-16+
InChIKey RXRCDSISIPEEDJ-AEQNYHIXSA-N
Mol Weight 518.98 g/mol
Molecular Formula C25H19ClN6O3S
Exact Mass 518.092787 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ip8YBCc8gOE
Name acetic acid, [[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E,2E)-3-(2-nitrophenyl)-2-propenylidene]hydrazide
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/C25H19ClN6O3S/c26-20-14-12-19(13-15-20)24-29-30-25(31(24)21-9-2-1-3-10-21)36-17-23(33)28-27-16-6-8-18-7-4-5-11-22(18)32(34)35/h1-16H,17H2,(H,28,33)/b8-6+,27-16+
InChIKey RXRCDSISIPEEDJ-AEQNYHIXSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5019
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: NMR/10248682