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

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3-pyridinecarboxamide, 5-cyano-1,4-dihydro-2-methyl-6-[[2-[(3-methylphenyl)amino]-2-oxoethyl]thio]-N-phenyl-4-(2-thienyl)-
SpectraBase Compound ID 1LZp4PjFjEk
InChI InChI=1S/C27H24N4O2S2/c1-17-8-6-11-20(14-17)30-23(32)16-35-27-21(15-28)25(22-12-7-13-34-22)24(18(2)29-27)26(33)31-19-9-4-3-5-10-19/h3-14,25,29H,16H2,1-2H3,(H,30,32)(H,31,33)
InChIKey BTNGJSWBONNKNF-UHFFFAOYSA-N
Mol Weight 500.64 g/mol
Molecular Formula C27H24N4O2S2
Exact Mass 500.134068 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID e5TF8n3Sgb
Name 3-pyridinecarboxamide, 5-cyano-1,4-dihydro-2-methyl-6-[[2-[(3-methylphenyl)amino]-2-oxoethyl]thio]-N-phenyl-4-(2-thienyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 500.134068375 u
Formula C27H24N4O2S2
InChI InChI=1S/C27H24N4O2S2/c1-17-8-6-11-20(14-17)30-23(32)16-35-27-21(15-28)25(22-12-7-13-34-22)24(18(2)29-27)26(33)31-19-9-4-3-5-10-19/h3-14,25,29H,16H2,1-2H3,(H,30,32)(H,31,33)
InChIKey BTNGJSWBONNKNF-UHFFFAOYSA-N
Molecular Weight 500.635 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7288
Solvent DMSO-d6
Source Vendor ID: NMR/10222657; Lab Info: KR; Lab Number: KR-KSG0086
Temperature 23.85 °C