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2,4-thiophenedicarboxylic acid, 5-[[[[5-[[(2-fluorobenzoyl)amino]methyl]-4-methyl-4H-1,2,4-triazol-3-yl]thio]acetyl]amino]-3-methyl-, diethyl ester

View entire compound with spectra: 1 NMR

2,4-thiophenedicarboxylic acid, 5-[[[[5-[[(2-fluorobenzoyl)amino]methyl]-4-methyl-4H-1,2,4-triazol-3-yl]thio]acetyl]amino]-3-methyl-, diethyl ester
SpectraBase Compound ID E6jy47JWq63
InChI InChI=1S/C24H26FN5O6S2/c1-5-35-22(33)18-13(3)19(23(34)36-6-2)38-21(18)27-17(31)12-37-24-29-28-16(30(24)4)11-26-20(32)14-9-7-8-10-15(14)25/h7-10H,5-6,11-12H2,1-4H3,(H,26,32)(H,27,31)
InChIKey OHGGRPXJSOBBCB-UHFFFAOYSA-N
Mol Weight 563.62 g/mol
Molecular Formula C24H26FN5O6S2
Exact Mass 563.130854 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E2lqwUcPgqD
Name 2,4-thiophenedicarboxylic acid, 5-[[[[5-[[(2-fluorobenzoyl)amino]methyl]-4-methyl-4H-1,2,4-triazol-3-yl]thio]acetyl]amino]-3-methyl-, diethyl ester
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/C24H26FN5O6S2/c1-5-35-22(33)18-13(3)19(23(34)36-6-2)38-21(18)27-17(31)12-37-24-29-28-16(30(24)4)11-26-20(32)14-9-7-8-10-15(14)25/h7-10H,5-6,11-12H2,1-4H3,(H,26,32)(H,27,31)
InChIKey OHGGRPXJSOBBCB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6683
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: NMR/10278694