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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((E)-{3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)-5-(1-piperidinylmethyl)-1H-1,2,3-triazole-4-carbohydrazide

View entire compound with spectra: 1 NMR

1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((E)-{3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)-5-(1-piperidinylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID HLwgWMUBQ9e
InChI InChI=1S/C25H31N11O3/c1-16-11-17(2)35(30-16)14-19-12-18(7-8-21(19)38-3)13-27-29-25(37)22-20(15-34-9-5-4-6-10-34)36(33-28-22)24-23(26)31-39-32-24/h7-8,11-13H,4-6,9-10,14-15H2,1-3H3,(H2,26,31)(H,29,37)/b27-13+
InChIKey JGOMAJDTIKYRQL-UVHMKAGCSA-N
Mol Weight 533.6 g/mol
Molecular Formula C25H31N11O3
Exact Mass 533.261134 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Jh0zKqLzh36
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((E)-{3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)-5-(1-piperidinylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
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/C25H31N11O3/c1-16-11-17(2)35(30-16)14-19-12-18(7-8-21(19)38-3)13-27-29-25(37)22-20(15-34-9-5-4-6-10-34)36(33-28-22)24-23(26)31-39-32-24/h7-8,11-13H,4-6,9-10,14-15H2,1-3H3,(H2,26,31)(H,29,37)/b27-13+
InChIKey JGOMAJDTIKYRQL-UVHMKAGCSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_15925
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: UZI/8052765; UBI_ID: UBI-015928
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-({3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)-5-(1-piperidinylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Temperature 313 °C