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1,2,4-Triazol-5(1H)-thione, 4-(4-acetylphenyl)-3-(4-methoxyphenyl)-
SpectraBase Compound ID EYiOKOpJ6eH
InChI InChI=1S/C17H15N3O2S/c1-11(21)12-3-7-14(8-4-12)20-16(18-19-17(20)23)13-5-9-15(22-2)10-6-13/h3-10H,1-2H3,(H,19,23)
InChIKey BIKCDGXDJQHGRS-UHFFFAOYSA-N
Mol Weight 325.39 g/mol
Molecular Formula C17H15N3O2S
Exact Mass 325.088498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H2mXGPegrei
Name 1,2,4-Triazol-5(1H)-thione, 4-(4-acetylphenyl)-3-(4-methoxyphenyl)-
Alternate Name(s) 1-(4-[3-(4-Methoxyphenyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]phenyl)ethanone 1-[4-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]phenyl]ethanone 1-[4-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]phenyl]ethanone
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Formula C17H15N3O2S
InChI InChI=1S/C17H15N3O2S/c1-11(21)12-3-7-14(8-4-12)20-16(18-19-17(20)23)13-5-9-15(22-2)10-6-13/h3-10H,1-2H3,(H,19,23)
InChIKey BIKCDGXDJQHGRS-UHFFFAOYSA-N
Molecular Weight 325.386 g/mol
SMILES N1N=C(N(C1=S)c1ccc(cc1)C(=O)C)c1ccc(cc1)OC
SPLASH splash10-0096-9503000000-7e4a05c6ad646b630d30
Wiley ID 1457455