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4-[5-(2-Fluoro-benzylsulfanyl)-4-phenyl-4H-[1,2,4]triazol-3-yl]-pyridine
SpectraBase Compound ID 376GAbBLabs
InChI InChI=1S/C20H15FN4S/c21-18-9-5-4-6-16(18)14-26-20-24-23-19(15-10-12-22-13-11-15)25(20)17-7-2-1-3-8-17/h1-13H,14H2
InChIKey VFCDKTWWHZIAOS-UHFFFAOYSA-N
Mol Weight 362.43 g/mol
Molecular Formula C20H15FN4S
Exact Mass 362.100146 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DtBhfAY6GpF
Name 4-[5-(2-Fluoro-benzylsulfanyl)-4-phenyl-4H-[1,2,4]triazol-3-yl]-pyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15FN4S
InChI InChI=1S/C20H15FN4S/c21-18-9-5-4-6-16(18)14-26-20-24-23-19(15-10-12-22-13-11-15)25(20)17-7-2-1-3-8-17/h1-13H,14H2
InChIKey VFCDKTWWHZIAOS-UHFFFAOYSA-N
Molecular Weight 362.426 g/mol
SMILES c1ccc(-[n]2c(nnc2SCc2c(F)cccc2)-c2ccncc2)cc1
SPLASH splash10-0pdi-7931000000-9f96aca5f79fa22e0466
Synonyms 4-[5-[(2-fluorobenzyl)thio]-4-phenyl-1,2,4-triazol-3-yl]pyridine 4-[5-[(2-fluorophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]pyridine 4-[5-[(2-fluorophenyl)methylthio]-4-phenyl-1,2,4-triazol-3-yl]pyridine
Wiley ID 1458853