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3-pyridinecarboxamide, N-(4-chlorophenyl)-5-cyano-4-(4-methoxyphenyl)-2-methyl-6-[[2-[(4-methylphenyl)amino]-2-oxoethyl]thio]-

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3-pyridinecarboxamide, N-(4-chlorophenyl)-5-cyano-4-(4-methoxyphenyl)-2-methyl-6-[[2-[(4-methylphenyl)amino]-2-oxoethyl]thio]-
SpectraBase Compound ID GpxXQNBMQ6S
InChI InChI=1S/C30H25ClN4O3S/c1-18-4-10-22(11-5-18)34-26(36)17-39-30-25(16-32)28(20-6-14-24(38-3)15-7-20)27(19(2)33-30)29(37)35-23-12-8-21(31)9-13-23/h4-15H,17H2,1-3H3,(H,34,36)(H,35,37)
InChIKey RCSQUVXBROVXTH-UHFFFAOYSA-N
Mol Weight 557.07 g/mol
Molecular Formula C30H25ClN4O3S
Exact Mass 556.13359 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CMl72pEZFvD
Name 3-pyridinecarboxamide, N-(4-chlorophenyl)-5-cyano-4-(4-methoxyphenyl)-2-methyl-6-[[2-[(4-methylphenyl)amino]-2-oxoethyl]thio]-
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/C30H25ClN4O3S/c1-18-4-10-22(11-5-18)34-26(36)17-39-30-25(16-32)28(20-6-14-24(38-3)15-7-20)27(19(2)33-30)29(37)35-23-12-8-21(31)9-13-23/h4-15H,17H2,1-3H3,(H,34,36)(H,35,37)
InChIKey RCSQUVXBROVXTH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2315
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/11238642