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5-cyano-6-{[2-(2-ethylanilino)-2-oxoethyl]sulfanyl}-2-methyl-N-(2-methylphenyl)-4-(2-thienyl)-1,4-dihydro-3-pyridinecarboxamide

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5-cyano-6-{[2-(2-ethylanilino)-2-oxoethyl]sulfanyl}-2-methyl-N-(2-methylphenyl)-4-(2-thienyl)-1,4-dihydro-3-pyridinecarboxamide
SpectraBase Compound ID C7KXq9d8nmV
InChI InChI=1S/C29H28N4O2S2/c1-4-20-11-6-8-13-23(20)32-25(34)17-37-29-21(16-30)27(24-14-9-15-36-24)26(19(3)31-29)28(35)33-22-12-7-5-10-18(22)2/h5-15,27,31H,4,17H2,1-3H3,(H,32,34)(H,33,35)
InChIKey HCYWKQZFDUIIIH-UHFFFAOYSA-N
Mol Weight 528.69 g/mol
Molecular Formula C29H28N4O2S2
Exact Mass 528.165369 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6YqhQU3DSOG
Name 5-cyano-6-{[2-(2-ethylanilino)-2-oxoethyl]sulfanyl}-2-methyl-N-(2-methylphenyl)-4-(2-thienyl)-1,4-dihydro-3-pyridinecarboxamide
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/C29H28N4O2S2/c1-4-20-11-6-8-13-23(20)32-25(34)17-37-29-21(16-30)27(24-14-9-15-36-24)26(19(3)31-29)28(35)33-22-12-7-5-10-18(22)2/h5-15,27,31H,4,17H2,1-3H3,(H,32,34)(H,33,35)
InChIKey HCYWKQZFDUIIIH-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_3341
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/10211908; Labnumber: KR-KSG1G18
Temperature 303 °C