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3-pyridinecarboxamide, 6-[[2-[(4-butoxyphenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-2-methyl-N,4-diphenyl-
SpectraBase Compound ID KHHIDyWG6zZ
InChI InChI=1S/C32H32N4O3S/c1-3-4-19-39-26-17-15-25(16-18-26)35-28(37)21-40-32-27(20-33)30(23-11-7-5-8-12-23)29(22(2)34-32)31(38)36-24-13-9-6-10-14-24/h5-18,30,34H,3-4,19,21H2,1-2H3,(H,35,37)(H,36,38)
InChIKey VZGXSBRPYBPWGG-UHFFFAOYSA-N
Mol Weight 552.7 g/mol
Molecular Formula C32H32N4O3S
Exact Mass 552.219512 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5L4Xu17fxW6
Name 3-pyridinecarboxamide, 6-[[2-[(4-butoxyphenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-2-methyl-N,4-diphenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 552.219512077 u
Formula C32H32N4O3S
InChI InChI=1S/C32H32N4O3S/c1-3-4-19-39-26-17-15-25(16-18-26)35-28(37)21-40-32-27(20-33)30(23-11-7-5-8-12-23)29(22(2)34-32)31(38)36-24-13-9-6-10-14-24/h5-18,30,34H,3-4,19,21H2,1-2H3,(H,35,37)(H,36,38)
InChIKey VZGXSBRPYBPWGG-UHFFFAOYSA-N
Molecular Weight 552.693 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10530
Solvent DMSO-d6
Source Vendor ID: NMR/10251805; Lab Info: KR; Lab Number: KR-KV00173