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ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl}-2-phenyl-1,4-dihydro-3-pyridinecarboxylate
SpectraBase Compound ID 4f3YvaL4y2N
InChI InChI=1S/C30H26ClN3O4S/c1-3-38-30(36)27-26(20-13-7-8-14-22(20)31)21(17-32)29(34-28(27)19-11-5-4-6-12-19)39-18-25(35)33-23-15-9-10-16-24(23)37-2/h4-16,26,34H,3,18H2,1-2H3,(H,33,35)
InChIKey MOHQLMPHVJJONN-UHFFFAOYSA-N
Mol Weight 560.07 g/mol
Molecular Formula C30H26ClN3O4S
Exact Mass 559.133255 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HwXP9aE7Qog
Name ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(2-methoxyanilino)-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 559.133255199 u
Formula C30H26ClN3O4S
InChI InChI=1S/C30H26ClN3O4S/c1-3-38-30(36)27-26(20-13-7-8-14-22(20)31)21(17-32)29(34-28(27)19-11-5-4-6-12-19)39-18-25(35)33-23-15-9-10-16-24(23)37-2/h4-16,26,34H,3,18H2,1-2H3,(H,33,35)
InChIKey MOHQLMPHVJJONN-UHFFFAOYSA-N
Molecular Weight 560.068 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1717
Solvent DMSO-d6
Source Vendor ID: NMR/12278298