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4-[((E)-{5-[(4-bromophenoxy)methyl]-2-furyl}methylidene)amino]-5-methyl-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 8wmLqBEcwWa
InChI InChI=1S/C15H13BrN4O2S/c1-10-18-19-15(23)20(10)17-8-13-6-7-14(22-13)9-21-12-4-2-11(16)3-5-12/h2-8H,9H2,1H3,(H,19,23)/b17-8+
InChIKey XEOVIQVIECOLEO-CAOOACKPSA-N
Mol Weight 393.26 g/mol
Molecular Formula C15H13BrN4O2S
Exact Mass 391.99426 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID C5wdJKR9xX0
Name 4-[((E)-{5-[(4-bromophenoxy)methyl]-2-furyl}methylidene)amino]-5-methyl-4H-1,2,4-triazole-3-thiol
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/C15H13BrN4O2S/c1-10-18-19-15(23)20(10)17-8-13-6-7-14(22-13)9-21-12-4-2-11(16)3-5-12/h2-8H,9H2,1H3,(H,19,23)/b17-8+
InChIKey XEOVIQVIECOLEO-CAOOACKPSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_29820
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: 1287524; SBI_ID: SBI-029824
Synonyms 4-[((E)-{5-[(4-bromophenoxy)methyl]-2-furyl}methylidene)amino]-5-methyl-4H-1,2,4-triazol-3-yl hydrosulfide4-[({5-[(4-bromophenoxy)methyl]-2-furyl}methylidene)amino]-5-methyl-4H-1,2,4-triazole-3-thiol
Temperature 308 °C