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ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(4-ethylanilino)-2-oxoethyl]sulfanyl}-2-phenyl-1,4-dihydro-3-pyridinecarboxylate
SpectraBase Compound ID 8Fe3Bqr2fY9
InChI InChI=1S/C31H28ClN3O3S/c1-3-20-14-16-22(17-15-20)34-26(36)19-39-30-24(18-33)27(23-12-8-9-13-25(23)32)28(31(37)38-4-2)29(35-30)21-10-6-5-7-11-21/h5-17,27,35H,3-4,19H2,1-2H3,(H,34,36)
InChIKey BVUXLCZDRDEJPO-UHFFFAOYSA-N
Mol Weight 558.1 g/mol
Molecular Formula C31H28ClN3O3S
Exact Mass 557.153991 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8r2qM5tCjhI
Name ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(4-ethylanilino)-2-oxoethyl]sulfanyl}-2-phenyl-1,4-dihydro-3-pyridinecarboxylate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 557.153990645 u
Formula C31H28ClN3O3S
InChI InChI=1S/C31H28ClN3O3S/c1-3-20-14-16-22(17-15-20)34-26(36)19-39-30-24(18-33)27(23-12-8-9-13-25(23)32)28(31(37)38-4-2)29(35-30)21-10-6-5-7-11-21/h5-17,27,35H,3-4,19H2,1-2H3,(H,34,36)
InChIKey BVUXLCZDRDEJPO-UHFFFAOYSA-N
Molecular Weight 558.096 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1716
Solvent DMSO-d6
Source Vendor ID: NMR/12278297