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3-pyridinecarboxamide, 6-[[2-[(4-bromophenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-N-(2-methoxyphenyl)-2-methyl-4-phenyl-

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3-pyridinecarboxamide, 6-[[2-[(4-bromophenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-N-(2-methoxyphenyl)-2-methyl-4-phenyl-
SpectraBase Compound ID 4GWQM6Q2g6P
InChI InChI=1S/C29H25BrN4O3S/c1-18-26(28(36)34-23-10-6-7-11-24(23)37-2)27(19-8-4-3-5-9-19)22(16-31)29(32-18)38-17-25(35)33-21-14-12-20(30)13-15-21/h3-15,27,32H,17H2,1-2H3,(H,33,35)(H,34,36)
InChIKey YCGAXRHNBQFFJD-UHFFFAOYSA-N
Mol Weight 589.51 g/mol
Molecular Formula C29H25BrN4O3S
Exact Mass 588.083075 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HLbCmirwa8I
Name 3-pyridinecarboxamide, 6-[[2-[(4-bromophenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-N-(2-methoxyphenyl)-2-methyl-4-phenyl-
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/C29H25BrN4O3S/c1-18-26(28(36)34-23-10-6-7-11-24(23)37-2)27(19-8-4-3-5-9-19)22(16-31)29(32-18)38-17-25(35)33-21-14-12-20(30)13-15-21/h3-15,27,32H,17H2,1-2H3,(H,33,35)(H,34,36)
InChIKey YCGAXRHNBQFFJD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2153
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/11238436