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2-[1-benzyl-3-(4-methoxybenzyl)-5-oxo-2-thioxo-4-imidazolidinyl]-N-(4-chlorophenyl)acetamide
SpectraBase Compound ID AGOidmp2Ugd
InChI InChI=1S/C26H24ClN3O3S/c1-33-22-13-7-19(8-14-22)16-29-23(15-24(31)28-21-11-9-20(27)10-12-21)25(32)30(26(29)34)17-18-5-3-2-4-6-18/h2-14,23H,15-17H2,1H3,(H,28,31)
InChIKey MESLZXCHOVAFCS-UHFFFAOYSA-N
Mol Weight 494.01 g/mol
Molecular Formula C26H24ClN3O3S
Exact Mass 493.122691 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2WTAvvx8SOy
Name 2-[1-Benzyl-3-(4-methoxybenzyl)-5-oxo-2-thioxo-4-imidazolidinyl]-N-(4-chlorophenyl)acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 493.122690516 u
Formula C26H24ClN3O3S
InChI InChI=1S/C26H24ClN3O3S/c1-33-22-13-7-19(8-14-22)16-29-23(15-24(31)28-21-11-9-20(27)10-12-21)25(32)30(26(29)34)17-18-5-3-2-4-6-18/h2-14,23H,15-17H2,1H3,(H,28,31)
InChIKey MESLZXCHOVAFCS-UHFFFAOYSA-N
Molecular Weight 494.009 g/mol
SMILES N(C(CC1C(N(C(N1CC1=CC=C(C=C1)OC)=S)CC1=CC=CC=C1)=O)=O)C1=CC=C(C=C1)Cl