SpectraBase Compound ID | 4dFPnrCsQTm |
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InChI | InChI=1S/C19H14BrN7S/c1-11-3-9-15(10-4-11)26-12(2)16(21-25-26)17-22-23-19-27(17)24-18(28-19)13-5-7-14(20)8-6-13/h3-10H,1-2H3 |
InChIKey | RYQDWFDKQXGXMG-UHFFFAOYSA-N |
Mol Weight | 452.33 g/mol |
Molecular Formula | C19H14BrN7S |
Exact Mass | 451.021478 g/mol |
SpectraBase Spectrum ID | FZEYYd7uRbJ |
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Name | 3-[5-Methyl-1-(4-methylphenyl)-1,2,3-triazol-4-yl]-6-(p-bromophenyl)-1,3,4-triazolo[3,4-b]-1,3,4-thiadiazole |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C19H14BrN7S |
InChI | InChI=1S/C19H14BrN7S/c1-11-3-9-15(10-4-11)26-12(2)16(21-25-26)17-22-23-19-27(17)24-18(28-19)13-5-7-14(20)8-6-13/h3-10H,1-2H3 |
InChIKey | RYQDWFDKQXGXMG-UHFFFAOYSA-N |
Molecular Weight | 452.334 g/mol |
SMILES | c1([n]2c(nn1)SC(=N2)c1ccc(cc1)Br)-c1nn[n](c1C)-c1ccc(cc1)C |
SPLASH | splash10-01bc-9720700000-f2d69a61de4fea1120bf |
Source of Spectrum | QA-48-345-6 |
Synonyms | 3-[5-Methyl-1-(4-methylphenyl)-1,2,3-triazol-4-yl]-6-(p-bromophenyl)-1,2,4-triazolo[3,4-b]-1,3,4-thiadiazole 6-(4-bromophenyl)-3-[5-methyl-1-(4-methylphenyl)-4-triazolyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole 6-(4-bromophenyl)-3-[5-methyl-1-(4-methylphenyl)triazol-4-yl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole 6-(4-bromophenyl)-3-[5-methyl-1-(4-methylphenyl)-1,2,3-triazol-4-yl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
Wiley ID | 863463 |