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N-(4-chlorophenyl)-5-cyano-6-((2-((2,4-dimethylphenyl)amino)-2-oxoethyl)thio)-2-methyl-1,4-dihydro-[4,4'-bipyridine]-3-carboxamide
SpectraBase Compound ID 2gowdItlKwe
InChI InChI=1S/C29H26ClN5O2S/c1-17-4-9-24(18(2)14-17)35-25(36)16-38-29-23(15-31)27(20-10-12-32-13-11-20)26(19(3)33-29)28(37)34-22-7-5-21(30)6-8-22/h4-14,27,33H,16H2,1-3H3,(H,34,37)(H,35,36)
InChIKey ZHBFCMJKLUNTIA-UHFFFAOYSA-N
Mol Weight 544.07 g/mol
Molecular Formula C29H26ClN5O2S
Exact Mass 543.149574 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CCACDBLeGQQ
Name N-(4-chlorophenyl)-5-cyano-6-((2-((2,4-dimethylphenyl)amino)-2-oxoethyl)thio)-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/C29H26ClN5O2S/c1-17-4-9-24(18(2)14-17)35-25(36)16-38-29-23(15-31)27(20-10-12-32-13-11-20)26(19(3)33-29)28(37)34-22-7-5-21(30)6-8-22/h4-14,27,33H,16H2,1-3H3,(H,34,37)(H,35,36)
InChIKey ZHBFCMJKLUNTIA-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2322
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/11238650