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3-pyridinecarboxylic acid, 6-[[2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl]thio]-4-(2-chlorophenyl)-5-cyano-1,4-dihydro-2-methyl-, 2-methoxyethyl ester

View entire compound with spectra: 1 NMR

3-pyridinecarboxylic acid, 6-[[2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl]thio]-4-(2-chlorophenyl)-5-cyano-1,4-dihydro-2-methyl-, 2-methoxyethyl ester
SpectraBase Compound ID 8mnoAJhSopC
InChI InChI=1S/C26H25Cl2N3O4S/c1-15-19(27)9-6-10-21(15)31-22(32)14-36-25-18(13-29)24(17-7-4-5-8-20(17)28)23(16(2)30-25)26(33)35-12-11-34-3/h4-10,24,30H,11-12,14H2,1-3H3,(H,31,32)
InChIKey CURSBTOVTVIJMS-UHFFFAOYSA-N
Mol Weight 546.47 g/mol
Molecular Formula C26H25Cl2N3O4S
Exact Mass 545.094283 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4tnxkSHn23
Name 3-pyridinecarboxylic acid, 6-[[2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl]thio]-4-(2-chlorophenyl)-5-cyano-1,4-dihydro-2-methyl-, 2-methoxyethyl 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/C26H25Cl2N3O4S/c1-15-19(27)9-6-10-21(15)31-22(32)14-36-25-18(13-29)24(17-7-4-5-8-20(17)28)23(16(2)30-25)26(33)35-12-11-34-3/h4-10,24,30H,11-12,14H2,1-3H3,(H,31,32)
InChIKey CURSBTOVTVIJMS-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2228
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/11238527