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

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2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,5-dimethoxyphenyl)methylidene]acetohydrazide
SpectraBase Compound ID 7ZOADyvryMI
InChI InChI=1S/C30H33N5O4S/c1-30(2,3)22-9-7-20(8-10-22)28-33-34-29(35(28)23-11-13-24(37-4)14-12-23)40-19-27(36)32-31-18-21-17-25(38-5)15-16-26(21)39-6/h7-18H,19H2,1-6H3,(H,32,36)/b31-18+
InChIKey CNVDPUIAZYVVGJ-FDAWAROLSA-N
Mol Weight 559.7 g/mol
Molecular Formula C30H33N5O4S
Exact Mass 559.225326 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6aIjMiab9b7
Name 2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,5-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/C30H33N5O4S/c1-30(2,3)22-9-7-20(8-10-22)28-33-34-29(35(28)23-11-13-24(37-4)14-12-23)40-19-27(36)32-31-18-21-17-25(38-5)15-16-26(21)39-6/h7-18H,19H2,1-6H3,(H,32,36)/b31-18+
InChIKey CNVDPUIAZYVVGJ-FDAWAROLSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_6677
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: D23928; Labnumber: GRES-01652; SBI_ID: SBI-006680
Synonyms 2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,5-dimethoxyphenyl)methylidene]acetohydrazide
Temperature 318 °C