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N-((E)-{5-[(2-chlorophenoxy)methyl]-2-furyl}methylidene)-3-(ethylsulfanyl)-5-(2-furyl)-4H-1,2,4-triazol-4-amine
SpectraBase Compound ID G81bqMvXt7H
InChI InChI=1S/C20H17ClN4O3S/c1-2-29-20-24-23-19(18-8-5-11-26-18)25(20)22-12-14-9-10-15(28-14)13-27-17-7-4-3-6-16(17)21/h3-12H,2,13H2,1H3/b22-12+
InChIKey KUKHFODSMFPWGD-WSDLNYQXSA-N
Mol Weight 428.89 g/mol
Molecular Formula C20H17ClN4O3S
Exact Mass 428.070989 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3bltpTBUhgy
Name N-((E)-{5-[(2-chlorophenoxy)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/C20H17ClN4O3S/c1-2-29-20-24-23-19(18-8-5-11-26-18)25(20)22-12-14-9-10-15(28-14)13-27-17-7-4-3-6-16(17)21/h3-12H,2,13H2,1H3/b22-12+
InChIKey KUKHFODSMFPWGD-WSDLNYQXSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31132
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: 1734803; SBI_ID: SBI-031136
Synonyms N-((E)-{5-[(2-chlorophenoxy)methyl]-2-furyl}methylidene)-N-[3-(ethylsulfanyl)-5-(2-furyl)-4H-1,2,4-triazol-4-yl]amineN-({5-[(2-chlorophenoxy)methyl]-2-furyl}methylidene)-3-(ethylsulfanyl)-5-(2-furyl)-4H-1,2,4-triazol-4-amine
Temperature 308 °C