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2-(4,5-diphenyl-2-sulfanyl-1H-imidazol-1-yl)-1-(4-fluorophenyl)ethanone

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2-(4,5-diphenyl-2-sulfanyl-1H-imidazol-1-yl)-1-(4-fluorophenyl)ethanone
SpectraBase Compound ID 4MSlLoPBpUv
InChI InChI=1S/C23H17FN2OS/c24-19-13-11-16(12-14-19)20(27)15-26-22(18-9-5-2-6-10-18)21(25-23(26)28)17-7-3-1-4-8-17/h1-14H,15H2,(H,25,28)
InChIKey GPDFMBUARLCYEQ-UHFFFAOYSA-N
Mol Weight 388.46 g/mol
Molecular Formula C23H17FN2OS
Exact Mass 388.104563 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E1fiFayvYsV
Name 1-(4-Fluoro-phenyl)-2-(2-mercapto-4,5-diphenyl-imidazol-1-yl)-ethanone
Comments Computed using HOSE algorithm
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Exact Mass 388.104562511 u
Formula C23H17FN2OS
InChI InChI=1S/C23H17FN2OS/c24-19-13-11-16(12-14-19)20(27)15-26-22(18-9-5-2-6-10-18)21(25-23(26)28)17-7-3-1-4-8-17/h1-14H,15H2,(H,25,28)
InChIKey GPDFMBUARLCYEQ-UHFFFAOYSA-N
Molecular Weight 388.460 g/mol
SMILES C1(=NC(=C(N1CC(=O)C=1C=CC(=CC1)F)C1=CC=CC=C1)C1=CC=CC=C1)S