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2-{[4,5-bis(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,4-dimethoxyphenyl)methylidene]acetohydrazide
SpectraBase Compound ID 6MDUYEORAQn
InChI InChI=1S/C25H21Cl2N5O3S/c1-34-21-12-5-17(22(13-21)35-2)14-28-29-23(33)15-36-25-31-30-24(16-3-6-18(26)7-4-16)32(25)20-10-8-19(27)9-11-20/h3-14H,15H2,1-2H3,(H,29,33)/b28-14+
InChIKey VQHVLHBKGGXPHO-CCVNUDIWSA-N
Mol Weight 542.44 g/mol
Molecular Formula C25H21Cl2N5O3S
Exact Mass 541.074216 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HT11bCCVdeS
Name 2-{[4,5-bis(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,4-dimethoxyphenyl)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/C25H21Cl2N5O3S/c1-34-21-12-5-17(22(13-21)35-2)14-28-29-23(33)15-36-25-31-30-24(16-3-6-18(26)7-4-16)32(25)20-10-8-19(27)9-11-20/h3-14H,15H2,1-2H3,(H,29,33)/b28-14+
InChIKey VQHVLHBKGGXPHO-CCVNUDIWSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_15309
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: C24865; Labnumber: UGRES-07800; SBI_ID: SBI-015312
Synonyms 2-{[4,5-bis(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,4-dimethoxyphenyl)methylidene]acetohydrazide
Temperature 318 °C