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

View entire compound with spectra: 1 NMR

3-pyridinecarboxamide, 6-[[2-[(4-chloro-2,5-dimethoxyphenyl)amino]-2-oxoethyl]thio]-4-(4-chlorophenyl)-5-cyano-2-methyl-N-(2-methylphenyl)-
SpectraBase Compound ID 3hJZuMfLm1P
InChI InChI=1S/C31H26Cl2N4O4S/c1-17-7-5-6-8-23(17)37-30(39)28-18(2)35-31(21(15-34)29(28)19-9-11-20(32)12-10-19)42-16-27(38)36-24-14-25(40-3)22(33)13-26(24)41-4/h5-14H,16H2,1-4H3,(H,36,38)(H,37,39)
InChIKey SCBQVNNNAYHVJL-UHFFFAOYSA-N
Mol Weight 621.54 g/mol
Molecular Formula C31H26Cl2N4O4S
Exact Mass 620.105182 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FwQIT50wKVA
Name 3-pyridinecarboxamide, 6-[[2-[(4-chloro-2,5-dimethoxyphenyl)amino]-2-oxoethyl]thio]-4-(4-chlorophenyl)-5-cyano-2-methyl-N-(2-methylphenyl)-
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/C31H26Cl2N4O4S/c1-17-7-5-6-8-23(17)37-30(39)28-18(2)35-31(21(15-34)29(28)19-9-11-20(32)12-10-19)42-16-27(38)36-24-14-25(40-3)22(33)13-26(24)41-4/h5-14H,16H2,1-4H3,(H,36,38)(H,37,39)
InChIKey SCBQVNNNAYHVJL-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2196
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/11238485