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4-{[(E)-(2-bromophenyl)methylidene]amino}-5-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 5wKaXrqvVBg
InChI InChI=1S/C17H15BrN4OS/c1-2-23-14-9-7-12(8-10-14)16-20-21-17(24)22(16)19-11-13-5-3-4-6-15(13)18/h3-11H,2H2,1H3,(H,21,24)/b19-11+
InChIKey WTELJGNQAHYKHC-YBFXNURJSA-N
Mol Weight 403.3 g/mol
Molecular Formula C17H15BrN4OS
Exact Mass 402.014995 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FjCmZZyaMtd
Name 4-{[(E)-(2-bromophenyl)methylidene]amino}-5-(4-ethoxyphenyl)-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/C17H15BrN4OS/c1-2-23-14-9-7-12(8-10-14)16-20-21-17(24)22(16)19-11-13-5-3-4-6-15(13)18/h3-11H,2H2,1H3,(H,21,24)/b19-11+
InChIKey WTELJGNQAHYKHC-YBFXNURJSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17040
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: D25405; Labnumber: GRES-03645; SBI_ID: SBI-017043
Synonyms 4-{[(E)-(2-bromophenyl)methylidene]amino}-5-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl hydrosulfide4-{[(2-bromophenyl)methylidene]amino}-5-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Temperature 308 °C