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N-(4-butylphenyl)-2-{[5-(2-fluorophenyl)-4-(2-furylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

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N-(4-butylphenyl)-2-{[5-(2-fluorophenyl)-4-(2-furylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID HCa6A0bWA1s
InChI InChI=1S/C25H25FN4O2S/c1-2-3-7-18-11-13-19(14-12-18)27-23(31)17-33-25-29-28-24(21-9-4-5-10-22(21)26)30(25)16-20-8-6-15-32-20/h4-6,8-15H,2-3,7,16-17H2,1H3,(H,27,31)
InChIKey SKFBNNLPHNODMY-UHFFFAOYSA-N
Mol Weight 464.56 g/mol
Molecular Formula C25H25FN4O2S
Exact Mass 464.168225 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1KVm3oh0Z0e
Name N-(4-butylphenyl)-2-{[5-(2-fluorophenyl)-4-(2-furylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
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/C25H25FN4O2S/c1-2-3-7-18-11-13-19(14-12-18)27-23(31)17-33-25-29-28-24(21-9-4-5-10-22(21)26)30(25)16-20-8-6-15-32-20/h4-6,8-15H,2-3,7,16-17H2,1H3,(H,27,31)
InChIKey SKFBNNLPHNODMY-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4965
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: E08437; Labnumber: GRES-37061; SBI_ID: SBI-004967
Temperature 308 °C