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3-pyridinecarboxamide, 6-[[2-[(4-chloro-2,5-dimethoxyphenyl)amino]-2-oxoethyl]thio]-5-cyano-1,4-dihydro-2-methyl-N,4-diphenyl-
SpectraBase Compound ID HWKqV3EDFek
InChI InChI=1S/C30H27ClN4O4S/c1-18-27(29(37)34-20-12-8-5-9-13-20)28(19-10-6-4-7-11-19)21(16-32)30(33-18)40-17-26(36)35-23-15-24(38-2)22(31)14-25(23)39-3/h4-15,28,33H,17H2,1-3H3,(H,34,37)(H,35,36)
InChIKey LPMJBBKPPUESOB-UHFFFAOYSA-N
Mol Weight 575.08 g/mol
Molecular Formula C30H27ClN4O4S
Exact Mass 574.144154 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KcCGVAxwZPW
Name 3-pyridinecarboxamide, 6-[[2-[(4-chloro-2,5-dimethoxyphenyl)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 574.144154235 u
Formula C30H27ClN4O4S
InChI InChI=1S/C30H27ClN4O4S/c1-18-27(29(37)34-20-12-8-5-9-13-20)28(19-10-6-4-7-11-19)21(16-32)30(33-18)40-17-26(36)35-23-15-24(38-2)22(31)14-25(23)39-3/h4-15,28,33H,17H2,1-3H3,(H,34,37)(H,35,36)
InChIKey LPMJBBKPPUESOB-UHFFFAOYSA-N
Molecular Weight 575.083 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10523
Solvent DMSO-d6
Source Vendor ID: NMR/10251797; Lab Info: KR; Lab Number: KR-KV00165