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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(diethylamino)-2-hydroxyphenyl]methylidene}-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID 6ybehYshE1k
InChI InChI=1S/C23H25N9O3S/c1-3-31(4-2)16-11-10-15(19(33)12-16)13-25-27-23(34)20-18(14-36-17-8-6-5-7-9-17)32(30-26-20)22-21(24)28-35-29-22/h5-13,33H,3-4,14H2,1-2H3,(H2,24,28)(H,27,34)/b25-13+
InChIKey ZWZIYKAZZMBKMS-DHRITJCHSA-N
Mol Weight 507.57 g/mol
Molecular Formula C23H25N9O3S
Exact Mass 507.180107 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JlhZZz3WsGU
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(diethylamino)-2-hydroxyphenyl]methylidene}-5-[(phenylsulfanyl)methyl]-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/C23H25N9O3S/c1-3-31(4-2)16-11-10-15(19(33)12-16)13-25-27-23(34)20-18(14-36-17-8-6-5-7-9-17)32(30-26-20)22-21(24)28-35-29-22/h5-13,33H,3-4,14H2,1-2H3,(H2,24,28)(H,27,34)/b25-13+
InChIKey ZWZIYKAZZMBKMS-DHRITJCHSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25145
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: D49264; Labnumber: NIG1-3068; SBI_ID: SBI-025149
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{[4-(diethylamino)-2-hydroxyphenyl]methylidene}-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 300 °C