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

*Links on SpectraBase are not permalinks.

3-pyridinecarboxylic acid, 6-[[2-[(4-bromophenyl)amino]-2-oxoethyl]thio]-5-cyano-4-(2-ethoxyphenyl)-1,2,3,4-tetrahydro-2-oxo-, methyl ester

View entire compound with spectra: 1 NMR

3-pyridinecarboxylic acid, 6-[[2-[(4-bromophenyl)amino]-2-oxoethyl]thio]-5-cyano-4-(2-ethoxyphenyl)-1,2,3,4-tetrahydro-2-oxo-, methyl ester
SpectraBase Compound ID K5DVzUp78q8
InChI InChI=1S/C24H22BrN3O5S/c1-3-33-18-7-5-4-6-16(18)20-17(12-26)23(28-22(30)21(20)24(31)32-2)34-13-19(29)27-15-10-8-14(25)9-11-15/h4-11,20-21H,3,13H2,1-2H3,(H,27,29)(H,28,30)
InChIKey FCDGHDWMQVDXJU-UHFFFAOYSA-N
Mol Weight 544.42 g/mol
Molecular Formula C24H22BrN3O5S
Exact Mass 543.046355 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 EhogCMJZcON
Name 3-pyridinecarboxylic acid, 6-[[2-[(4-bromophenyl)amino]-2-oxoethyl]thio]-5-cyano-4-(2-ethoxyphenyl)-1,2,3,4-tetrahydro-2-oxo-, methyl 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/C24H22BrN3O5S/c1-3-33-18-7-5-4-6-16(18)20-17(12-26)23(28-22(30)21(20)24(31)32-2)34-13-19(29)27-15-10-8-14(25)9-11-15/h4-11,20-21H,3,13H2,1-2H3,(H,27,29)(H,28,30)
InChIKey FCDGHDWMQVDXJU-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2096
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/11238363