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

View entire compound with spectra: 1 NMR

3-pyridinecarboxamide, 5-cyano-6-[[2-[(3,4-dichlorophenyl)amino]-2-oxoethyl]thio]-1,4-dihydro-2-methyl-N-phenyl-4-(2-thienyl)-
SpectraBase Compound ID HDmxJvoBlVc
InChI InChI=1S/C26H20Cl2N4O2S2/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 DMWLAZFOXPZUQI-UHFFFAOYSA-N
Mol Weight 555.5 g/mol
Molecular Formula C26H20Cl2N4O2S2
Exact Mass 554.040474 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5Ze1qWyNL85
Name 3-pyridinecarboxamide, 5-cyano-6-[[2-[(3,4-dichlorophenyl)amino]-2-oxoethyl]thio]-1,4-dihydro-2-methyl-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 554.040473646 u
Formula C26H20Cl2N4O2S2
InChI InChI=1S/C26H20Cl2N4O2S2/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 DMWLAZFOXPZUQI-UHFFFAOYSA-N
Molecular Weight 555.498 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6050
Solvent DMSO-d6
Source Vendor ID: NMR/10211907; Lab Info: KR; Lab Number: KR-KSG1G17
Temperature 29.85 °C