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2-(Benzylthio)-5-methyl-7-(4-methylphenyl)-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
SpectraBase Compound ID 49gPF57KtpW
InChI InChI=1S/C27H25N5OS/c1-18-13-15-21(16-14-18)24-23(25(33)29-22-11-7-4-8-12-22)19(2)28-26-30-27(31-32(24)26)34-17-20-9-5-3-6-10-20/h3-16,24H,17H2,1-2H3,(H,29,33)(H,28,30,31)
InChIKey NFDDHYRFPLIFLL-UHFFFAOYSA-N
Mol Weight 467.59 g/mol
Molecular Formula C27H25N5OS
Exact Mass 467.177982 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9TWjS30qZhW
Name 2-(Benzylthio)-5-methyl-7-(4-methylphenyl)-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H25N5OS
InChI InChI=1S/C27H25N5OS/c1-18-13-15-21(16-14-18)24-23(25(33)29-22-11-7-4-8-12-22)19(2)28-26-30-27(31-32(24)26)34-17-20-9-5-3-6-10-20/h3-16,24H,17H2,1-2H3,(H,29,33)(H,28,30,31)
InChIKey NFDDHYRFPLIFLL-UHFFFAOYSA-N
Molecular Weight 467.591 g/mol
SMILES N1c2[n](C(C(C(Nc3ccccc3)=O)=C1C)c1ccc(cc1)C)nc(n2)SCc1ccccc1
SPLASH splash10-0006-9103000000-16a2c39c833eb33e9c2f
Source of Spectrum F-67-9395-5c
Synonyms 5-Methyl-7-(4-methylphenyl)-N-phenyl-2-(phenylmethylthio)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide 2-Benzylsulfanyl-5-methyl-7-(4-methylphenyl)-N-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide 2-Benzylsulfanyl-5-methyl-N-phenyl-7-(p-tolyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide 5-Methyl-7-(4-methylphenyl)-N-phenyl-2-(phenylmethylsulfanyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Wiley ID 1691227