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

*Links on SpectraBase are not permalinks.
6-{[2-(3-chloroanilino)-2-oxoethyl]sulfanyl}-5-cyano-2-methyl-N-phenyl-4-(2-thienyl)-1,4-dihydro-3-pyridinecarboxamide
SpectraBase Compound ID JWyw8YO2PL6
InChI InChI=1S/C26H21ClN4O2S2/c1-16-23(25(33)31-18-8-3-2-4-9-18)24(21-11-6-12-34-21)20(14-28)26(29-16)35-15-22(32)30-19-10-5-7-17(27)13-19/h2-13,24,29H,15H2,1H3,(H,30,32)(H,31,33)
InChIKey FEFFQHLRYVUWHX-UHFFFAOYSA-N
Mol Weight 521.05 g/mol
Molecular Formula C26H21ClN4O2S2
Exact Mass 520.079446 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 AwoH9u1TRNr
Name 6-{[2-(3-chloroanilino)-2-oxoethyl]sulfanyl}-5-cyano-2-methyl-N-phenyl-4-(2-thienyl)-1,4-dihydro-3-pyridinecarboxamide
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/C26H21ClN4O2S2/c1-16-23(25(33)31-18-8-3-2-4-9-18)24(21-11-6-12-34-21)20(14-28)26(29-16)35-15-22(32)30-19-10-5-7-17(27)13-19/h2-13,24,29H,15H2,1H3,(H,30,32)(H,31,33)
InChIKey FEFFQHLRYVUWHX-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_3349
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/10211922; Labnumber: KR-KSG1G33
Temperature 297 °C