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ethyl 5-cyano-6-{[2-(4-ethylanilino)-2-oxoethyl]sulfanyl}-4-(2-furyl)-2-phenyl-1,4-dihydro-3-pyridinecarboxylate
SpectraBase Compound ID 4jE5v8wQAN7
InChI InChI=1S/C29H27N3O4S/c1-3-19-12-14-21(15-13-19)31-24(33)18-37-28-22(17-30)25(23-11-8-16-36-23)26(29(34)35-4-2)27(32-28)20-9-6-5-7-10-20/h5-16,25,32H,3-4,18H2,1-2H3,(H,31,33)
InChIKey WXTBHQBTWCUYIJ-UHFFFAOYSA-N
Mol Weight 513.61 g/mol
Molecular Formula C29H27N3O4S
Exact Mass 513.172228 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID XTZOJgY0Ii
Name ethyl 5-cyano-6-{[2-(4-ethylanilino)-2-oxoethyl]sulfanyl}-4-(2-furyl)-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 513.172227531 u
Formula C29H27N3O4S
InChI InChI=1S/C29H27N3O4S/c1-3-19-12-14-21(15-13-19)31-24(33)18-37-28-22(17-30)25(23-11-8-16-36-23)26(29(34)35-4-2)27(32-28)20-9-6-5-7-10-20/h5-16,25,32H,3-4,18H2,1-2H3,(H,31,33)
InChIKey WXTBHQBTWCUYIJ-UHFFFAOYSA-N
Molecular Weight 513.612 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1710
Solvent DMSO-d6
Source Vendor ID: NMR/12278291