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3-pyridinecarboxamide, 5-cyano-4-(2-ethoxyphenyl)-1,4-dihydro-2-methyl-6-(methylthio)-N-phenyl-
SpectraBase Compound ID BTStW9LorfD
InChI InChI=1S/C23H23N3O2S/c1-4-28-19-13-9-8-12-17(19)21-18(14-24)23(29-3)25-15(2)20(21)22(27)26-16-10-6-5-7-11-16/h5-13,21,25H,4H2,1-3H3,(H,26,27)
InChIKey HNIISCIRVJHEIP-UHFFFAOYSA-N
Mol Weight 405.52 g/mol
Molecular Formula C23H23N3O2S
Exact Mass 405.151098 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5qOHV2djmtQ
Name 3-pyridinecarboxamide, 5-cyano-4-(2-ethoxyphenyl)-1,4-dihydro-2-methyl-6-(methylthio)-N-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 405.151098165 u
Formula C23H23N3O2S
InChI InChI=1S/C23H23N3O2S/c1-4-28-19-13-9-8-12-17(19)21-18(14-24)23(29-3)25-15(2)20(21)22(27)26-16-10-6-5-7-11-16/h5-13,21,25H,4H2,1-3H3,(H,26,27)
InChIKey HNIISCIRVJHEIP-UHFFFAOYSA-N
Molecular Weight 405.516 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8983
Solvent DMSO-d6
Source Vendor ID: NMR/9253165; Lab Info: KR; Lab Number: KR-0000017