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acetamide, N-(4-bromophenyl)-2-[[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

acetamide, N-(4-bromophenyl)-2-[[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID HGkWsmU8qG1
InChI InChI=1S/C22H16BrFN4OS/c23-16-9-11-18(12-10-16)25-20(29)14-30-22-27-26-21(15-5-4-6-17(24)13-15)28(22)19-7-2-1-3-8-19/h1-13H,14H2,(H,25,29)
InChIKey CWTFHQQRHDKENI-UHFFFAOYSA-N
Mol Weight 483.36 g/mol
Molecular Formula C22H16BrFN4OS
Exact Mass 482.021223 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dpo3hxWUOJa
Name N-(4-bromophenyl)-2-[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16BrFN4OS
InChI InChI=1S/C22H16BrFN4OS/c23-16-9-11-18(12-10-16)25-20(29)14-30-22-27-26-21(15-5-4-6-17(24)13-15)28(22)19-7-2-1-3-8-19/h1-13H,14H2,(H,25,29)
InChIKey CWTFHQQRHDKENI-UHFFFAOYSA-N
Molecular Weight 483.359 g/mol
SMILES N(C(CSc1[n](c(nn1)-c1cc(F)ccc1)-c1ccccc1)=O)c1ccc(cc1)Br
SPLASH splash10-01r6-9632000000-37d5a8d43f785d21bc3d
Synonyms N-(4-bromophenyl)-2-[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide N-(4-bromophenyl)-2-[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetamide
Wiley ID 1459919