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5-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinolin-8-ol
SpectraBase Compound ID 2aAtirbMiWn
InChI InChI=1S/C25H20N4O2S/c1-31-20-10-5-7-17(15-20)24-27-28-25(29(24)19-8-3-2-4-9-19)32-16-18-12-13-22(30)23-21(18)11-6-14-26-23/h2-15,30H,16H2,1H3
InChIKey NYKOGGWBULEWFF-UHFFFAOYSA-N
Mol Weight 440.52 g/mol
Molecular Formula C25H20N4O2S
Exact Mass 440.130697 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5VHsNeF4zLE
Name 5-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinolin-8-ol
Alternate Name(s) 5-[[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-8-quinolinol 5-[[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]quinolin-8-ol
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Formula C25H20N4O2S
InChI InChI=1S/C25H20N4O2S/c1-31-20-10-5-7-17(15-20)24-27-28-25(29(24)19-8-3-2-4-9-19)32-16-18-12-13-22(30)23-21(18)11-6-14-26-23/h2-15,30H,16H2,1H3
InChIKey NYKOGGWBULEWFF-UHFFFAOYSA-N
Molecular Weight 440.521 g/mol
SMILES Oc1ccc(CSc2[n](c(-c3cccc(OC)c3)nn2)-c2ccccc2)c2c1nccc2
SPLASH splash10-0a4i-8910000000-82792bce22abc45085d6
Wiley ID 1512449