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3-pyridinecarboxamide, 5-cyano-6-[[2-[(3,4-dichlorophenyl)amino]-2-oxoethyl]thio]-4-(2-furanyl)-1,4-dihydro-2-methyl-N-phenyl-

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3-pyridinecarboxamide, 5-cyano-6-[[2-[(3,4-dichlorophenyl)amino]-2-oxoethyl]thio]-4-(2-furanyl)-1,4-dihydro-2-methyl-N-phenyl-
SpectraBase Compound ID FnXVOTtJs7z
InChI InChI=1S/C26H20Cl2N4O3S/c1-15-23(25(34)32-16-6-3-2-4-7-16)24(21-8-5-11-35-21)18(13-29)26(30-15)36-14-22(33)31-17-9-10-19(27)20(28)12-17/h2-12,24,30H,14H2,1H3,(H,31,33)(H,32,34)
InChIKey BPXMFXILVIPGTM-UHFFFAOYSA-N
Mol Weight 539.44 g/mol
Molecular Formula C26H20Cl2N4O3S
Exact Mass 538.063317 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5fKwT7BDMFs
Name 3-pyridinecarboxamide, 5-cyano-6-[[2-[(3,4-dichlorophenyl)amino]-2-oxoethyl]thio]-4-(2-furanyl)-1,4-dihydro-2-methyl-N-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 538.063317091 u
Formula C26H20Cl2N4O3S
InChI InChI=1S/C26H20Cl2N4O3S/c1-15-23(25(34)32-16-6-3-2-4-7-16)24(21-8-5-11-35-21)18(13-29)26(30-15)36-14-22(33)31-17-9-10-19(27)20(28)12-17/h2-12,24,30H,14H2,1H3,(H,31,33)(H,32,34)
InChIKey BPXMFXILVIPGTM-UHFFFAOYSA-N
Molecular Weight 539.437 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10447
Solvent DMSO-d6
Source Vendor ID: NMR/10211943; Lab Info: KR; Lab Number: KR-KSG0054
Temperature 23.85 °C