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1-[4-amino-6-(N-phenylanilino)-1,3,5-triazin-2-yl]-5-methyl-4-triazolecarboxylic acid ethyl ester
SpectraBase Compound ID CVUkVSxi04a
InChI InChI=1S/C21H20N8O2/c1-3-31-18(30)17-14(2)29(27-26-17)21-24-19(22)23-20(25-21)28(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13H,3H2,1-2H3,(H2,22,23,24,25)
InChIKey PEQWZHZSUAKUNL-UHFFFAOYSA-N
Mol Weight 416.45 g/mol
Molecular Formula C21H20N8O2
Exact Mass 416.170922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2U5nWCQg00R
Name 1-[4-amino-6-(N-phenylanilino)-1,3,5-triazin-2-yl]-5-methyl-4-triazolecarboxylic acid ethyl ester
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Formula C21H20N8O2
InChI InChI=1S/C21H20N8O2/c1-3-31-18(30)17-14(2)29(27-26-17)21-24-19(22)23-20(25-21)28(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13H,3H2,1-2H3,(H2,22,23,24,25)
InChIKey PEQWZHZSUAKUNL-UHFFFAOYSA-N
Molecular Weight 416.445 g/mol
SMILES Nc1nc(nc(-[n]2nnc(c2C)C(=O)OCC)n1)N(c1ccccc1)c1ccccc1
SPLASH splash10-014j-6912000000-b788a8baf0822ef6cc98
Synonyms 1-[4-amino-6-(N-phenylanilino)-s-triazin-2-yl]-5-methyl-triazole-4-carboxylic acid ethyl ester Ethyl 1-[4-amino-6-(diphenylamino)-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazole-4-carboxylate Ethyl 1-[4-amino-6-(N-phenylanilino)-1,3,5-triazin-2-yl]-5-methyl-triazole-4-carboxylate Ethyl 1-[4-azanyl-6-(diphenylamino)-1,3,5-triazin-2-yl]-5-methyl-1,2,3-triazole-4-carboxylate
Wiley ID 1443898