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

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3-pyridinecarboxamide, 5-cyano-6-[[2-[(3,5-dichlorophenyl)amino]-2-oxoethyl]thio]-1,4-dihydro-2-methyl-N-(2-methylphenyl)-4-phenyl-
SpectraBase Compound ID DZhjdmgQ9mc
InChI InChI=1S/C29H24Cl2N4O2S/c1-17-8-6-7-11-24(17)35-28(37)26-18(2)33-29(23(15-32)27(26)19-9-4-3-5-10-19)38-16-25(36)34-22-13-20(30)12-21(31)14-22/h3-14,27,33H,16H2,1-2H3,(H,34,36)(H,35,37)
InChIKey SKBJEMLULWWIIA-UHFFFAOYSA-N
Mol Weight 563.5 g/mol
Molecular Formula C29H24Cl2N4O2S
Exact Mass 562.099703 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6etUdsxXmKG
Name 3-pyridinecarboxamide, 5-cyano-6-[[2-[(3,5-dichlorophenyl)amino]-2-oxoethyl]thio]-1,4-dihydro-2-methyl-N-(2-methylphenyl)-4-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 562.099702601 u
Formula C29H24Cl2N4O2S
InChI InChI=1S/C29H24Cl2N4O2S/c1-17-8-6-7-11-24(17)35-28(37)26-18(2)33-29(23(15-32)27(26)19-9-4-3-5-10-19)38-16-25(36)34-22-13-20(30)12-21(31)14-22/h3-14,27,33H,16H2,1-2H3,(H,34,36)(H,35,37)
InChIKey SKBJEMLULWWIIA-UHFFFAOYSA-N
Molecular Weight 563.503 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10533
Solvent DMSO-d6
Source Vendor ID: NMR/10251815; Lab Info: KR; Lab Number: KR-KV00183