For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(Z)-(3-ethoxy-2-hydroxyphenyl)methylidene]hydrazide

View entire compound with spectra: 2 NMR

acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(Z)-(3-ethoxy-2-hydroxyphenyl)methylidene]hydrazide
SpectraBase Compound ID 3vHOMaGN4pD
InChI InChI=1S/C26H24ClN5O3S/c1-3-35-22-6-4-5-19(24(22)34)15-28-29-23(33)16-36-26-31-30-25(18-9-11-20(27)12-10-18)32(26)21-13-7-17(2)8-14-21/h4-15,34H,3,16H2,1-2H3,(H,29,33)/b28-15-
InChIKey WPUPNSGMXLSUGY-MBTHVWNTSA-N
Mol Weight 522.02 g/mol
Molecular Formula C26H24ClN5O3S
Exact Mass 521.128839 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FJ4YMd6qTjo
Name Acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(Z)-(3-ethoxy-2-hydroxyphenyl)methylidene]hydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 521.128838524 u
Formula C26H24ClN5O3S
InChI InChI=1S/C26H24ClN5O3S/c1-3-35-22-6-4-5-19(24(22)34)15-28-29-23(33)16-36-26-31-30-25(18-9-11-20(27)12-10-18)32(26)21-13-7-17(2)8-14-21/h4-15,34H,3,16H2,1-2H3,(H,29,33)/b28-15-
InChIKey WPUPNSGMXLSUGY-MBTHVWNTSA-N
Molecular Weight 522.023 g/mol
SMILES N(\N=C/C=1C(=C(C=CC1)OCC)O)C(CSC=1N(C(=NN1)C1=CC=C(C=C1)Cl)C=1C=CC(=CC1)C)=O