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Ethyl 7-(4-methylphenyl)-2-methylthio-5-methyl-4,7-dihydro-1,2,4-triazolo[1,5-a]pyrimidine-6-carboxylate
SpectraBase Compound ID EMSMRRoy1Vz
InChI InChI=1S/C17H20N4O2S/c1-5-23-15(22)13-11(3)18-16-19-17(24-4)20-21(16)14(13)12-8-6-10(2)7-9-12/h6-9,14H,5H2,1-4H3,(H,18,19,20)
InChIKey KPASHRKONJRQOG-UHFFFAOYSA-N
Mol Weight 344.43 g/mol
Molecular Formula C17H20N4O2S
Exact Mass 344.130697 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2NOmB358DI
Name Ethyl 7-(4-methylphenyl)-2-methylthio-5-methyl-4,7-dihydro-1,2,4-triazolo[1,5-a]pyrimidine-6-carboxylate
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Formula C17H20N4O2S
InChI InChI=1S/C17H20N4O2S/c1-5-23-15(22)13-11(3)18-16-19-17(24-4)20-21(16)14(13)12-8-6-10(2)7-9-12/h6-9,14H,5H2,1-4H3,(H,18,19,20)
InChIKey KPASHRKONJRQOG-UHFFFAOYSA-N
Molecular Weight 344.433 g/mol
SMILES N1C(=C(C([n]2c1nc(n2)SC)c1ccc(cc1)C)C(=O)OCC)C
SPLASH splash10-0f95-0295000000-0301e8d0ea5e0be40c33
Source of Spectrum Y-46-144-5b
Synonyms 5-Methyl-7-(4-methylphenyl)-2-(methylthio)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester Ethyl 5-methyl-2-methylsulfanyl-7-(p-tolyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Ethyl 5-methyl-7-(4-methylphenyl)-2-methylsulfanyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Wiley ID 1666717