For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
methyl 4-[({[4-(2-furylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
SpectraBase Compound ID FsoQBWpXnVS
InChI InChI=1S/C24H22N4O5S/c1-31-19-6-3-5-17(13-19)22-26-27-24(28(22)14-20-7-4-12-33-20)34-15-21(29)25-18-10-8-16(9-11-18)23(30)32-2/h3-13H,14-15H2,1-2H3,(H,25,29)
InChIKey DYZDUIPSYFMQMT-UHFFFAOYSA-N
Mol Weight 478.52 g/mol
Molecular Formula C24H22N4O5S
Exact Mass 478.131091 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BsrkRybTk8P
Name methyl 4-[({[4-(2-furylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
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/C24H22N4O5S/c1-31-19-6-3-5-17(13-19)22-26-27-24(28(22)14-20-7-4-12-33-20)34-15-21(29)25-18-10-8-16(9-11-18)23(30)32-2/h3-13H,14-15H2,1-2H3,(H,25,29)
InChIKey DYZDUIPSYFMQMT-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11451
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: E06348; Labnumber: GRES-21073; SBI_ID: SBI-011454
Temperature 308 °C