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2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(5-methyl-2-thienyl)methylidene]acetohydrazide

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2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(5-methyl-2-thienyl)methylidene]acetohydrazide
SpectraBase Compound ID AVM1PPrntxn
InChI InChI=1S/C27H29N5OS2/c1-18-6-13-22(14-7-18)32-25(20-9-11-21(12-10-20)27(3,4)5)30-31-26(32)34-17-24(33)29-28-16-23-15-8-19(2)35-23/h6-16H,17H2,1-5H3,(H,29,33)/b28-16+
InChIKey TVMNHJQQCQJYCT-LQKURTRISA-N
Mol Weight 503.68 g/mol
Molecular Formula C27H29N5OS2
Exact Mass 503.181353 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HnqP7vxf1x4
Name 2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(5-methyl-2-thienyl)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/C27H29N5OS2/c1-18-6-13-22(14-7-18)32-25(20-9-11-21(12-10-20)27(3,4)5)30-31-26(32)34-17-24(33)29-28-16-23-15-8-19(2)35-23/h6-16H,17H2,1-5H3,(H,29,33)/b28-16+
InChIKey TVMNHJQQCQJYCT-LQKURTRISA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_634
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: C24595; Labnumber: UGRES-06298; SBI_ID: SBI-000636
Synonyms 2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(5-methyl-2-thienyl)methylidene]acetohydrazide
Temperature 308 °C