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

View entire compound with spectra: 1 NMR

3-pyridinecarboxamide, 5-cyano-1,4-dihydro-6-[[2-[(4-methoxyphenyl)amino]-2-oxoethyl]thio]-2-methyl-N-phenyl-4-(2-thienyl)-
SpectraBase Compound ID 4nkxENmnn6Q
InChI InChI=1S/C27H24N4O3S2/c1-17-24(26(33)31-18-7-4-3-5-8-18)25(22-9-6-14-35-22)21(15-28)27(29-17)36-16-23(32)30-19-10-12-20(34-2)13-11-19/h3-14,25,29H,16H2,1-2H3,(H,30,32)(H,31,33)
InChIKey WFQGGKQOLBZUNW-UHFFFAOYSA-N
Mol Weight 516.63 g/mol
Molecular Formula C27H24N4O3S2
Exact Mass 516.128983 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID M78dy1MQ9g
Name 3-pyridinecarboxamide, 5-cyano-1,4-dihydro-6-[[2-[(4-methoxyphenyl)amino]-2-oxoethyl]thio]-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 516.128982994 u
Formula C27H24N4O3S2
InChI InChI=1S/C27H24N4O3S2/c1-17-24(26(33)31-18-7-4-3-5-8-18)25(22-9-6-14-35-22)21(15-28)27(29-17)36-16-23(32)30-19-10-12-20(34-2)13-11-19/h3-14,25,29H,16H2,1-2H3,(H,30,32)(H,31,33)
InChIKey WFQGGKQOLBZUNW-UHFFFAOYSA-N
Molecular Weight 516.634 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7723
Solvent DMSO-d6
Source Vendor ID: NMR/10231920; Lab Info: KR; Lab Number: KR-KC00077
Temperature 23.85 °C