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2-(Benzylthio)-N-(2-methoxyphenyl)-5-methyl-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
SpectraBase Compound ID JZbsn2odLtL
InChI InChI=1S/C27H25N5O2S/c1-18-23(25(33)29-21-15-9-10-16-22(21)34-2)24(20-13-7-4-8-14-20)32-26(28-18)30-27(31-32)35-17-19-11-5-3-6-12-19/h3-16,24H,17H2,1-2H3,(H,29,33)(H,28,30,31)
InChIKey FUBQYYBDZKVILB-UHFFFAOYSA-N
Mol Weight 483.59 g/mol
Molecular Formula C27H25N5O2S
Exact Mass 483.172896 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1MVsyiZFU0y
Name 2-(Benzylthio)-N-(2-methoxyphenyl)-5-methyl-7-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 C27H25N5O2S
InChI InChI=1S/C27H25N5O2S/c1-18-23(25(33)29-21-15-9-10-16-22(21)34-2)24(20-13-7-4-8-14-20)32-26(28-18)30-27(31-32)35-17-19-11-5-3-6-12-19/h3-16,24H,17H2,1-2H3,(H,29,33)(H,28,30,31)
InChIKey FUBQYYBDZKVILB-UHFFFAOYSA-N
Molecular Weight 483.590 g/mol
SMILES N1c2[n](C(C(C(Nc3c(OC)cccc3)=O)=C1C)c1ccccc1)nc(n2)SCc1ccccc1
SPLASH splash10-01vo-7906100000-9a8b4744aa2843c1e13b
Source of Spectrum F-67-9395-5f
Synonyms N-(2-methoxyphenyl)-5-methyl-7-phenyl-2-(phenylmethylthio)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide 2-Benzylsulfanyl-N-(2-methoxyphenyl)-5-methyl-7-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide N-(2-methoxyphenyl)-5-methyl-7-phenyl-2-(phenylmethylsulfanyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Wiley ID 1691224