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4-{[(E)-(2-methoxy-1-naphthyl)methylidene]amino}-5-(2-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID IWuS0tlDexH
InChI InChI=1S/C21H18N4O2S/c1-26-18-10-6-5-9-16(18)20-23-24-21(28)25(20)22-13-17-15-8-4-3-7-14(15)11-12-19(17)27-2/h3-13H,1-2H3,(H,24,28)/b22-13+
InChIKey MNLJNCKKSCPBDE-LPYMAVHISA-N
Mol Weight 390.46 g/mol
Molecular Formula C21H18N4O2S
Exact Mass 390.115047 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6jTxZ5t7MIG
Name 4-{[(E)-(2-methoxy-1-naphthyl)methylidene]amino}-5-(2-methoxyphenyl)-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/C21H18N4O2S/c1-26-18-10-6-5-9-16(18)20-23-24-21(28)25(20)22-13-17-15-8-4-3-7-14(15)11-12-19(17)27-2/h3-13H,1-2H3,(H,24,28)/b22-13+
InChIKey MNLJNCKKSCPBDE-LPYMAVHISA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16895
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: D25198; Labnumber: GRES-03247; SBI_ID: SBI-016898
Synonyms 4-{[(E)-(2-methoxy-1-naphthyl)methylidene]amino}-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl hydrosulfide4-{[(2-methoxy-1-naphthyl)methylidene]amino}-5-(2-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Temperature 315 °C