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Methyl 5-oxo-1-(p-tolyl)-7-(phenylamino)-1,2,4-triazolo[4,3-a]pyrimidine-3-carboxylate
SpectraBase Compound ID 1mucFzkNejA
InChI InChI=1S/C20H17N5O3/c1-13-8-10-15(11-9-13)25-20-22-16(21-14-6-4-3-5-7-14)12-17(26)24(20)18(23-25)19(27)28-2/h3-12,21H,1-2H3
InChIKey TVCCWOQQDYGLNU-UHFFFAOYSA-N
Mol Weight 375.39 g/mol
Molecular Formula C20H17N5O3
Exact Mass 375.133139 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3eE2BiTyMuX
Name Methyl 5-oxo-1-(p-tolyl)-7-(phenylamino)-1,2,4-triazolo[4,3-a]pyrimidine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17N5O3
InChI InChI=1S/C20H17N5O3/c1-13-8-10-15(11-9-13)25-20-22-16(21-14-6-4-3-5-7-14)12-17(26)24(20)18(23-25)19(27)28-2/h3-12,21H,1-2H3
InChIKey TVCCWOQQDYGLNU-UHFFFAOYSA-N
Molecular Weight 375.388 g/mol
SMILES N(C=1N=C2N(C(C1)=O)C(=NN2c1ccc(cc1)C)C(=O)OC)c1ccccc1
SPLASH splash10-056r-5679000000-f181ea18c04b82e010e8
Source of Spectrum H-86-746-20
Synonyms Methyl 7-anilino-1-(4-methylphenyl)-5-oxo-1,5-dihydro[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylate
Wiley ID 1525384