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2-(1-(4-chlorophenyl)-3-{3-[4-(4-fluorophenyl)-1-piperazinyl]propyl}-5-oxo-2-thioxo-4-imidazolidinyl)-N-(4-fluorophenyl)acetamide
SpectraBase Compound ID 9jCwF1juy2b
InChI InChI=1S/C30H30ClF2N5O2S/c31-21-2-10-26(11-3-21)38-29(40)27(20-28(39)34-24-8-4-22(32)5-9-24)37(30(38)41)15-1-14-35-16-18-36(19-17-35)25-12-6-23(33)7-13-25/h2-13,27H,1,14-20H2,(H,34,39)
InChIKey UYHIWZFUPPULIK-UHFFFAOYSA-N
Mol Weight 598.11 g/mol
Molecular Formula C30H30ClF2N5O2S
Exact Mass 597.17768 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 47NKg1eHNIm
Name 2-(1-(4-chlorophenyl)-3-{3-[4-(4-fluorophenyl)-1-piperazinyl]propyl}-5-oxo-2-thioxo-4-imidazolidinyl)-N-(4-fluorophenyl)acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 597.177680424 u
Formula C30H30ClF2N5O2S
InChI InChI=1S/C30H30ClF2N5O2S/c31-21-2-10-26(11-3-21)38-29(40)27(20-28(39)34-24-8-4-22(32)5-9-24)37(30(38)41)15-1-14-35-16-18-36(19-17-35)25-12-6-23(33)7-13-25/h2-13,27H,1,14-20H2,(H,34,39)
InChIKey UYHIWZFUPPULIK-UHFFFAOYSA-N
Molecular Weight 598.113 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8604
Solvent DMSO-d6
Source Vendor ID: NMR/13219888