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2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3,5-dimethyl-1-pentyl-1H-pyrazol-4-yl)methylidene]acetohydrazide

View entire compound with spectra: 1 NMR

2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3,5-dimethyl-1-pentyl-1H-pyrazol-4-yl)methylidene]acetohydrazide
SpectraBase Compound ID 3ExjD8NroS0
InChI InChI=1S/C29H35N7O3S/c1-6-7-11-16-35-21(3)24(20(2)34-35)18-30-31-27(37)19-40-29-33-32-28(36(29)23-12-9-8-10-13-23)22-14-15-25(38-4)26(17-22)39-5/h8-10,12-15,17-18H,6-7,11,16,19H2,1-5H3,(H,31,37)/b30-18+
InChIKey QOLVWHMXZBJNCN-UXHLAJHPSA-N
Mol Weight 561.7 g/mol
Molecular Formula C29H35N7O3S
Exact Mass 561.252209 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6Z7439be89C
Name 2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3,5-dimethyl-1-pentyl-1H-pyrazol-4-yl)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/C29H35N7O3S/c1-6-7-11-16-35-21(3)24(20(2)34-35)18-30-31-27(37)19-40-29-33-32-28(36(29)23-12-9-8-10-13-23)22-14-15-25(38-4)26(17-22)39-5/h8-10,12-15,17-18H,6-7,11,16,19H2,1-5H3,(H,31,37)/b30-18+
InChIKey QOLVWHMXZBJNCN-UXHLAJHPSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_14653
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: 987/00000073; Labnumber: 987/00000073218799; VK_ID: VK-014658
Synonyms 2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3,5-dimethyl-1-pentyl-1H-pyrazol-4-yl)methylidene]acetohydrazide
Temperature 318 °C