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2-{[4,5-bis(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(Z)-1-(2-hydroxyphenyl)ethylidene]acetohydrazide

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2-{[4,5-bis(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(Z)-1-(2-hydroxyphenyl)ethylidene]acetohydrazide
SpectraBase Compound ID AfmzYXtrGxc
InChI InChI=1S/C24H19Cl2N5O2S/c1-15(20-4-2-3-5-21(20)32)27-28-22(33)14-34-24-30-29-23(16-6-8-17(25)9-7-16)31(24)19-12-10-18(26)11-13-19/h2-13,32H,14H2,1H3,(H,28,33)/b27-15-
InChIKey LPIGISVSNBPQJH-DICXZTSXSA-N
Mol Weight 512.42 g/mol
Molecular Formula C24H19Cl2N5O2S
Exact Mass 511.063651 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9jutyZeXxYg
Name 2-{[4,5-bis(4-Chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(Z)-1-(2-hydroxyphenyl)ethylidene]acetohydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 511.063651444 u
Formula C24H19Cl2N5O2S
InChI InChI=1S/C24H19Cl2N5O2S/c1-15(20-4-2-3-5-21(20)32)27-28-22(33)14-34-24-30-29-23(16-6-8-17(25)9-7-16)31(24)19-12-10-18(26)11-13-19/h2-13,32H,14H2,1H3,(H,28,33)/b27-15-
InChIKey LPIGISVSNBPQJH-DICXZTSXSA-N
Molecular Weight 512.415 g/mol
SMILES N(\N=C/(C=1C(=CC=CC1)O)C)C(CSC=1N(C(=NN1)C=1C=CC(=CC1)Cl)C1=CC=C(C=C1)Cl)=O