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4-(4-bromophenyl)-3-(2-phenyl-1,8-naphthyridin-3-yl)-1H-1,2,4-triazole-5-thione
SpectraBase Compound ID GRK9PIYvtUQ
InChI InChI=1S/C22H14BrN5S/c23-16-8-10-17(11-9-16)28-21(26-27-22(28)29)18-13-15-7-4-12-24-20(15)25-19(18)14-5-2-1-3-6-14/h1-13H,(H,27,29)
InChIKey VCZZDRLBXKBFFJ-UHFFFAOYSA-N
Mol Weight 460.35 g/mol
Molecular Formula C22H14BrN5S
Exact Mass 459.01533 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ns3Gmyyv55
Name 4-(4-bromophenyl)-3-(2-phenyl-1,8-naphthyridin-3-yl)-1H-1,2,4-triazole-5-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H14BrN5S
InChI InChI=1S/C22H14BrN5S/c23-16-8-10-17(11-9-16)28-21(26-27-22(28)29)18-13-15-7-4-12-24-20(15)25-19(18)14-5-2-1-3-6-14/h1-13H,(H,27,29)
InChIKey VCZZDRLBXKBFFJ-UHFFFAOYSA-N
Molecular Weight 460.353 g/mol
SMILES Sc1[n](c(-c2c(nc3c(c2)cccn3)-c2ccccc2)nn1)-c1ccc(cc1)Br
SPLASH splash10-0a7i-0190100000-6b3fd6c420f9fdba4a5a
Source of Spectrum Y1-35-343-5
Wiley ID 1526635