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3-pyridinecarboxamide, 5-cyano-6-[[2-[(3,5-dichlorophenyl)amino]-2-oxoethyl]thio]-4-(2-furanyl)-1,4-dihydro-N-(2-methoxyphenyl)-2-methyl-
SpectraBase Compound ID FZkrzFUwi0h
InChI InChI=1S/C27H22Cl2N4O4S/c1-15-24(26(35)33-20-6-3-4-7-21(20)36-2)25(22-8-5-9-37-22)19(13-30)27(31-15)38-14-23(34)32-18-11-16(28)10-17(29)12-18/h3-12,25,31H,14H2,1-2H3,(H,32,34)(H,33,35)
InChIKey PWBIYSDMJMEGEP-UHFFFAOYSA-N
Mol Weight 569.46 g/mol
Molecular Formula C27H22Cl2N4O4S
Exact Mass 568.073882 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DxMggFnh6vh
Name 3-pyridinecarboxamide, 5-cyano-6-[[2-[(3,5-dichlorophenyl)amino]-2-oxoethyl]thio]-4-(2-furanyl)-1,4-dihydro-N-(2-methoxyphenyl)-2-methyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 568.073881774 u
Formula C27H22Cl2N4O4S
InChI InChI=1S/C27H22Cl2N4O4S/c1-15-24(26(35)33-20-6-3-4-7-21(20)36-2)25(22-8-5-9-37-22)19(13-30)27(31-15)38-14-23(34)32-18-11-16(28)10-17(29)12-18/h3-12,25,31H,14H2,1-2H3,(H,32,34)(H,33,35)
InChIKey PWBIYSDMJMEGEP-UHFFFAOYSA-N
Molecular Weight 569.463 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10557
Solvent DMSO-d6
Source Vendor ID: NMR/10251849; Lab Info: KR; Lab Number: KR-KV00231