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N-((E)-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}methylidene)-4H-1,2,4-triazol-4-amine
SpectraBase Compound ID 32KWTFk5tZR
InChI InChI=1S/C18H15N5OS2/c1-24-16-7-6-13(9-21-23-11-19-20-12-23)8-14(16)10-25-18-22-15-4-2-3-5-17(15)26-18/h2-9,11-12H,10H2,1H3/b21-9+
InChIKey WTVYDVMNEBMFIQ-ZVBGSRNCSA-N
Mol Weight 381.47 g/mol
Molecular Formula C18H15N5OS2
Exact Mass 381.071802 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Jq1hkFHvUB
Name N-((E)-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}methylidene)-4H-1,2,4-triazol-4-amine
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/C18H15N5OS2/c1-24-16-7-6-13(9-21-23-11-19-20-12-23)8-14(16)10-25-18-22-15-4-2-3-5-17(15)26-18/h2-9,11-12H,10H2,1H3/b21-9+
InChIKey WTVYDVMNEBMFIQ-ZVBGSRNCSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16056
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: D09859; Labnumber: KHAN-0022; SBI_ID: SBI-016059
Synonyms N-((E)-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}methylidene)-N-(4H-1,2,4-triazol-4-yl)amineN-({3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}methylidene)-4H-1,2,4-triazol-4-amine
Temperature 318 °C