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butanamide, N-cyclopentyl-2-[[(4E)-1-(4-ethoxyphenyl)-4,5-dihydro-4-[[4-(4-morpholinyl)phenyl]methylene]-5-oxo-1H-imidazol-2-yl]thio]-
SpectraBase Compound ID HAq3CX11BTi
InChI InChI=1S/C31H38N4O4S/c1-3-28(29(36)32-23-7-5-6-8-23)40-31-33-27(30(37)35(31)25-13-15-26(16-14-25)39-4-2)21-22-9-11-24(12-10-22)34-17-19-38-20-18-34/h9-16,21,23,28H,3-8,17-20H2,1-2H3,(H,32,36)/b27-21+
InChIKey ITFGXCCUBNZEEO-SZXQPVLSSA-N
Mol Weight 562.7 g/mol
Molecular Formula C31H38N4O4S
Exact Mass 562.261377 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID C0rtVoDJbtB
Name butanamide, N-cyclopentyl-2-[[(4E)-1-(4-ethoxyphenyl)-4,5-dihydro-4-[[4-(4-morpholinyl)phenyl]methylene]-5-oxo-1H-imidazol-2-yl]thio]-
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 562.261376890 u
Formula C31H38N4O4S
InChI InChI=1S/C31H38N4O4S/c1-3-28(29(36)32-23-7-5-6-8-23)40-31-33-27(30(37)35(31)25-13-15-26(16-14-25)39-4-2)21-22-9-11-24(12-10-22)34-17-19-38-20-18-34/h9-16,21,23,28H,3-8,17-20H2,1-2H3,(H,32,36)/b27-21+
InChIKey ITFGXCCUBNZEEO-SZXQPVLSSA-N
Molecular Weight 562.729 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2347
Solvent DMSO-d6
Source Vendor ID: NMR/13268644