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ethyl 5-cyano-6-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-4-(2-furyl)-2-phenyl-1,4-dihydro-3-pyridinecarboxylate
SpectraBase Compound ID 5gaaYSQskoE
InChI InChI=1S/C27H22FN3O4S/c1-2-34-27(33)24-23(21-9-6-14-35-21)20(15-29)26(31-25(24)17-7-4-3-5-8-17)36-16-22(32)30-19-12-10-18(28)11-13-19/h3-14,23,31H,2,16H2,1H3,(H,30,32)
InChIKey VFSZVBDGTMXTMJ-UHFFFAOYSA-N
Mol Weight 503.55 g/mol
Molecular Formula C27H22FN3O4S
Exact Mass 503.131506 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4mdGhWhdGDG
Name ethyl 5-cyano-6-{[2-(4-fluoroanilino)-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 503.131505533 u
Formula C27H22FN3O4S
InChI InChI=1S/C27H22FN3O4S/c1-2-34-27(33)24-23(21-9-6-14-35-21)20(15-29)26(31-25(24)17-7-4-3-5-8-17)36-16-22(32)30-19-12-10-18(28)11-13-19/h3-14,23,31H,2,16H2,1H3,(H,30,32)
InChIKey VFSZVBDGTMXTMJ-UHFFFAOYSA-N
Molecular Weight 503.548 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1666
Solvent DMSO-d6
Source Vendor ID: NMR/12278244