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ethyl 6-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-5-cyano-4-(2-furyl)-2-phenyl-1,4-dihydro-3-pyridinecarboxylate
SpectraBase Compound ID ErEPquF8AuN
InChI InChI=1S/C29H25N3O5S/c1-3-36-29(35)26-25(23-10-7-15-37-23)22(16-30)28(32-27(26)20-8-5-4-6-9-20)38-17-24(34)31-21-13-11-19(12-14-21)18(2)33/h4-15,25,32H,3,17H2,1-2H3,(H,31,34)
InChIKey CSYSLYUCPOZSGX-UHFFFAOYSA-N
Mol Weight 527.6 g/mol
Molecular Formula C29H25N3O5S
Exact Mass 527.151492 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GTxxZIo0fGx
Name ethyl 6-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-5-cyano-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 527.151492086 u
Formula C29H25N3O5S
InChI InChI=1S/C29H25N3O5S/c1-3-36-29(35)26-25(23-10-7-15-37-23)22(16-30)28(32-27(26)20-8-5-4-6-9-20)38-17-24(34)31-21-13-11-19(12-14-21)18(2)33/h4-15,25,32H,3,17H2,1-2H3,(H,31,34)
InChIKey CSYSLYUCPOZSGX-UHFFFAOYSA-N
Molecular Weight 527.595 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1714
Solvent DMSO-d6
Source Vendor ID: NMR/12278295