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3-(1H-indol-3-yl)-2-phenyl-4-(p-tolyl)-3H-1,2,4-triazole-5-carboxylic acid ethyl ester
SpectraBase Compound ID HxWFdi4e6Tf
InChI InChI=1S/C26H24N4O2/c1-3-32-26(31)24-28-30(20-9-5-4-6-10-20)25(29(24)19-15-13-18(2)14-16-19)22-17-27-23-12-8-7-11-21(22)23/h4-17,25,27H,3H2,1-2H3
InChIKey QJTKMWGQSNYXOQ-UHFFFAOYSA-N
Mol Weight 424.5 g/mol
Molecular Formula C26H24N4O2
Exact Mass 424.189926 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Spl9SdDPM
Name 3-(1H-indol-3-yl)-2-phenyl-4-(p-tolyl)-3H-1,2,4-triazole-5-carboxylic acid ethyl ester
Alternate Name(s) 3-(1H-indol-3-yl)-4-(4-methylphenyl)-2-phenyl-3H-1,2,4-triazole-5-carboxylic acid ethyl ester Ethyl 3-(1H-indol-3-yl)-2-phenyl-4-(p-tolyl)-3H-1,2,4-triazole-5-carboxylate Ethyl 3-(1H-indol-3-yl)-4-(4-methylphenyl)-2-phenyl-3H-1,2,4-triazole-5-carboxylate Ethyl 5-(1H-indol-3-yl)-4-(4-methylphenyl)-1-phenyl-4,5-dihydro-1H-1,2,4-triazole-3-carboxylate
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Formula C26H24N4O2
InChI InChI=1S/C26H24N4O2/c1-3-32-26(31)24-28-30(20-9-5-4-6-10-20)25(29(24)19-15-13-18(2)14-16-19)22-17-27-23-12-8-7-11-21(22)23/h4-17,25,27H,3H2,1-2H3
InChIKey QJTKMWGQSNYXOQ-UHFFFAOYSA-N
Molecular Weight 424.504 g/mol
SMILES [nH]1c2c(c(c1)C1N(C(=NN1c1ccccc1)C(=O)OCC)c1ccc(cc1)C)cccc2
SPLASH splash10-00di-2231900000-d3161a2c60426880dd64
Wiley ID 1454703