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N-(4-chlorophenyl)-6-((2-((4-chlorophenyl)amino)-2-oxoethyl)thio)-5-cyano-2-methyl-1,4-dihydro-[4,4'-bipyridine]-3-carboxamide

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N-(4-chlorophenyl)-6-((2-((4-chlorophenyl)amino)-2-oxoethyl)thio)-5-cyano-2-methyl-1,4-dihydro-[4,4'-bipyridine]-3-carboxamide
SpectraBase Compound ID 9ikb9nrYFtA
InChI InChI=1S/C27H21Cl2N5O2S/c1-16-24(26(36)34-21-8-4-19(29)5-9-21)25(17-10-12-31-13-11-17)22(14-30)27(32-16)37-15-23(35)33-20-6-2-18(28)3-7-20/h2-13,25,32H,15H2,1H3,(H,33,35)(H,34,36)
InChIKey VCEPFXJSVLSAPT-UHFFFAOYSA-N
Mol Weight 550.46 g/mol
Molecular Formula C27H21Cl2N5O2S
Exact Mass 549.079302 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EBt4BGu7C2z
Name N-(4-chlorophenyl)-6-((2-((4-chlorophenyl)amino)-2-oxoethyl)thio)-5-cyano-2-methyl-1,4-dihydro-[4,4'-bipyridine]-3-carboxamide
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/C27H21Cl2N5O2S/c1-16-24(26(36)34-21-8-4-19(29)5-9-21)25(17-10-12-31-13-11-17)22(14-30)27(32-16)37-15-23(35)33-20-6-2-18(28)3-7-20/h2-13,25,32H,15H2,1H3,(H,33,35)(H,34,36)
InChIKey VCEPFXJSVLSAPT-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2453
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/11238815