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3-pyridinecarboxylic acid, 5-cyano-1,2,3,4-tetrahydro-6-[[2-[(4-methoxyphenyl)amino]-2-oxoethyl]thio]-4-[4-(1-methylethyl)phenyl]-2-oxo-, methyl ester

View entire compound with spectra: 1 NMR

3-pyridinecarboxylic acid, 5-cyano-1,2,3,4-tetrahydro-6-[[2-[(4-methoxyphenyl)amino]-2-oxoethyl]thio]-4-[4-(1-methylethyl)phenyl]-2-oxo-, methyl ester
SpectraBase Compound ID FxfJyR1sT0H
InChI InChI=1S/C26H27N3O5S/c1-15(2)16-5-7-17(8-6-16)22-20(13-27)25(29-24(31)23(22)26(32)34-4)35-14-21(30)28-18-9-11-19(33-3)12-10-18/h5-12,15,22-23H,14H2,1-4H3,(H,28,30)(H,29,31)
InChIKey GFCUYHSIKGIQDX-UHFFFAOYSA-N
Mol Weight 493.58 g/mol
Molecular Formula C26H27N3O5S
Exact Mass 493.167142 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9EirKmtVSuK
Name 3-pyridinecarboxylic acid, 5-cyano-1,2,3,4-tetrahydro-6-[[2-[(4-methoxyphenyl)amino]-2-oxoethyl]thio]-4-[4-(1-methylethyl)phenyl]-2-oxo-, methyl ester
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/C26H27N3O5S/c1-15(2)16-5-7-17(8-6-16)22-20(13-27)25(29-24(31)23(22)26(32)34-4)35-14-21(30)28-18-9-11-19(33-3)12-10-18/h5-12,15,22-23H,14H2,1-4H3,(H,28,30)(H,29,31)
InChIKey GFCUYHSIKGIQDX-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2169
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/11238454