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methyl 6-[(2-anilino-2-oxoethyl)sulfanyl]-5-cyano-4-(2-fluorophenyl)-2-methyl-1,4-dihydro-3-pyridinecarboxylate
SpectraBase Compound ID 1rP5Nizwn4g
InChI InChI=1S/C23H20FN3O3S/c1-14-20(23(29)30-2)21(16-10-6-7-11-18(16)24)17(12-25)22(26-14)31-13-19(28)27-15-8-4-3-5-9-15/h3-11,21,26H,13H2,1-2H3,(H,27,28)
InChIKey DPNIAXQEQVPJSJ-UHFFFAOYSA-N
Mol Weight 437.49 g/mol
Molecular Formula C23H20FN3O3S
Exact Mass 437.120941 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5ierMNvp6Oi
Name methyl 6-[(2-anilino-2-oxoethyl)sulfanyl]-5-cyano-4-(2-fluorophenyl)-2-methyl-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 437.120940850 u
Formula C23H20FN3O3S
InChI InChI=1S/C23H20FN3O3S/c1-14-20(23(29)30-2)21(16-10-6-7-11-18(16)24)17(12-25)22(26-14)31-13-19(28)27-15-8-4-3-5-9-15/h3-11,21,26H,13H2,1-2H3,(H,27,28)
InChIKey DPNIAXQEQVPJSJ-UHFFFAOYSA-N
Molecular Weight 437.489 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1752
Solvent DMSO-d6
Source Vendor ID: NMR/12278348