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2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,3-dichlorophenyl)methylidene]acetohydrazide

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2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,3-dichlorophenyl)methylidene]acetohydrazide
SpectraBase Compound ID wWh5QreBRb
InChI InChI=1S/C24H25Cl2N5OS/c1-16-10-12-17(13-11-16)23-29-30-24(31(23)19-7-3-2-4-8-19)33-15-21(32)28-27-14-18-6-5-9-20(25)22(18)26/h5-6,9-14,19H,2-4,7-8,15H2,1H3,(H,28,32)/b27-14+
InChIKey SFZMMNMGMRMADB-MZJWZYIUSA-N
Mol Weight 502.46 g/mol
Molecular Formula C24H25Cl2N5OS
Exact Mass 501.115687 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8FkPiqF1QNo
Name 2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,3-dichlorophenyl)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/C24H25Cl2N5OS/c1-16-10-12-17(13-11-16)23-29-30-24(31(23)19-7-3-2-4-8-19)33-15-21(32)28-27-14-18-6-5-9-20(25)22(18)26/h5-6,9-14,19H,2-4,7-8,15H2,1H3,(H,28,32)/b27-14+
InChIKey SFZMMNMGMRMADB-MZJWZYIUSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16742
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: D24396; Labnumber: GRES-02374; SBI_ID: SBI-016745
Synonyms 2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,3-dichlorophenyl)methylidene]acetohydrazide
Temperature 318 °C