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N-(4-fluorophenyl)-2-[3-(4-methoxybenzyl)-1-methyl-5-oxo-2-thioxo-4-imidazolidinyl]acetamide
SpectraBase Compound ID 2hX3OEq5wmS
InChI InChI=1S/C20H20FN3O3S/c1-23-19(26)17(11-18(25)22-15-7-5-14(21)6-8-15)24(20(23)28)12-13-3-9-16(27-2)10-4-13/h3-10,17H,11-12H2,1-2H3,(H,22,25)
InChIKey RLAHWCWCFAHUGA-UHFFFAOYSA-N
Mol Weight 401.46 g/mol
Molecular Formula C20H20FN3O3S
Exact Mass 401.120941 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3yd3tHIMFwk
Name N-(4-Fluorophenyl)-2-[3-(4-methoxybenzyl)-1-methyl-5-oxo-2-thioxo-4-imidazolidinyl]acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 401.120940850 u
Formula C20H20FN3O3S
InChI InChI=1S/C20H20FN3O3S/c1-23-19(26)17(11-18(25)22-15-7-5-14(21)6-8-15)24(20(23)28)12-13-3-9-16(27-2)10-4-13/h3-10,17H,11-12H2,1-2H3,(H,22,25)
InChIKey RLAHWCWCFAHUGA-UHFFFAOYSA-N
Molecular Weight 401.456 g/mol
SMILES N(C(CC1C(N(C(N1CC1=CC=C(C=C1)OC)=S)C)=O)=O)C=1C=CC(=CC1)F