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N-((E)-{5-[(4-bromophenoxy)methyl]-2-furyl}methylidene)-3-(ethylsulfanyl)-5-(2-furyl)-4H-1,2,4-triazol-4-amine
SpectraBase Compound ID CiElR70P2i3
InChI InChI=1S/C20H17BrN4O3S/c1-2-29-20-24-23-19(18-4-3-11-26-18)25(20)22-12-16-9-10-17(28-16)13-27-15-7-5-14(21)6-8-15/h3-12H,2,13H2,1H3/b22-12+
InChIKey IIMKAWJCVXGQTJ-WSDLNYQXSA-N
Mol Weight 473.35 g/mol
Molecular Formula C20H17BrN4O3S
Exact Mass 472.020475 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K1oLf1TpDMn
Name N-((E)-{5-[(4-bromophenoxy)methyl]-2-furyl}methylidene)-3-(ethylsulfanyl)-5-(2-furyl)-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/C20H17BrN4O3S/c1-2-29-20-24-23-19(18-4-3-11-26-18)25(20)22-12-16-9-10-17(28-16)13-27-15-7-5-14(21)6-8-15/h3-12H,2,13H2,1H3/b22-12+
InChIKey IIMKAWJCVXGQTJ-WSDLNYQXSA-N
NMR Offset 17.9116
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_31239
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: 1749190; SBI_ID: SBI-031243
Synonyms N-((E)-{5-[(4-bromophenoxy)methyl]-2-furyl}methylidene)-N-[3-(ethylsulfanyl)-5-(2-furyl)-4H-1,2,4-triazol-4-yl]amineN-({5-[(4-bromophenoxy)methyl]-2-furyl}methylidene)-3-(ethylsulfanyl)-5-(2-furyl)-4H-1,2,4-triazol-4-amine
Temperature 303 °C