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4-imidazolidineacetamide, 1-(3-chloro-4-methoxyphenyl)-N-(4-chlorophenyl)-3-[3-[4-(4-fluorophenyl)-1-piperazinyl]propyl]-5-oxo-2-thioxo-
SpectraBase Compound ID 7MQoIAZ7XJe
InChI InChI=1S/C31H32Cl2FN5O3S/c1-42-28-12-11-25(19-26(28)33)39-30(41)27(20-29(40)35-23-7-3-21(32)4-8-23)38(31(39)43)14-2-13-36-15-17-37(18-16-36)24-9-5-22(34)6-10-24/h3-12,19,27H,2,13-18,20H2,1H3,(H,35,40)
InChIKey GIZRZGHJZHFZNI-UHFFFAOYSA-N
Mol Weight 644.6 g/mol
Molecular Formula C31H32Cl2FN5O3S
Exact Mass 643.158695 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FiR75yQDtuL
Name 4-imidazolidineacetamide, 1-(3-chloro-4-methoxyphenyl)-N-(4-chlorophenyl)-3-[3-[4-(4-fluorophenyl)-1-piperazinyl]propyl]-5-oxo-2-thioxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 643.158694644 u
Formula C31H32Cl2FN5O3S
InChI InChI=1S/C31H32Cl2FN5O3S/c1-42-28-12-11-25(19-26(28)33)39-30(41)27(20-29(40)35-23-7-3-21(32)4-8-23)38(31(39)43)14-2-13-36-15-17-37(18-16-36)24-9-5-22(34)6-10-24/h3-12,19,27H,2,13-18,20H2,1H3,(H,35,40)
InChIKey GIZRZGHJZHFZNI-UHFFFAOYSA-N
Molecular Weight 644.593 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2361
Solvent DMSO-d6
Source Vendor ID: NMR/13268684