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

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acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[4-(dimethylamino)phenyl]methylidene]hydrazide
SpectraBase Compound ID 9y6L8vu4IG1
InChI InChI=1S/C26H25ClN6OS/c1-18-4-12-23(13-5-18)33-25(20-8-10-21(27)11-9-20)30-31-26(33)35-17-24(34)29-28-16-19-6-14-22(15-7-19)32(2)3/h4-16H,17H2,1-3H3,(H,29,34)/b28-16+
InChIKey JRXALXHLQSECGV-LQKURTRISA-N
Mol Weight 505.04 g/mol
Molecular Formula C26H25ClN6OS
Exact Mass 504.149908 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IPNrMs7EBH5
Name acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[4-(dimethylamino)phenyl]methylidene]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/C26H25ClN6OS/c1-18-4-12-23(13-5-18)33-25(20-8-10-21(27)11-9-20)30-31-26(33)35-17-24(34)29-28-16-19-6-14-22(15-7-19)32(2)3/h4-16H,17H2,1-3H3,(H,29,34)/b28-16+
InChIKey JRXALXHLQSECGV-LQKURTRISA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5260
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/10249228