![7H-3-[5-Methyl-1-(4-methylphenyl)-1,2,3-triazol-4-yl]-1,2,3-triazol-4-yl]-6-phenyl-s-triazolo[3,4-b]-1,3,4-thiadiazine](/api/spectrum/38WpCBkwhk/structure.png?h=300&w=458 "7H-3-[5-Methyl-1-(4-methylphenyl)-1,2,3-triazol-4-yl]-1,2,3-triazol-4-yl]-6-phenyl-s-triazolo[3,4-b]-1,3,4-thiadiazine")
| SpectraBase Compound ID | 3Fu6fLKCOI1 |
|---|---|
| InChI | InChI=1S/C20H17N7S/c1-13-8-10-16(11-9-13)26-14(2)18(21-25-26)19-22-23-20-27(19)24-17(12-28-20)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3 |
| InChIKey | IABBMNXBUWAAQX-UHFFFAOYSA-N |
| Mol Weight | 387.47 g/mol |
| Molecular Formula | C20H17N7S |
| Exact Mass | 387.126615 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 38WpCBkwhk |
|---|---|
| Name | 7H-3-[5-Methyl-1-(4-methylphenyl)-1,2,3-triazol-4-yl]-1,2,3-triazol-4-yl]-6-phenyl-s-triazolo[3,4-b]-1,3,4-thiadiazine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H17N7S |
| InChI | InChI=1S/C20H17N7S/c1-13-8-10-16(11-9-13)26-14(2)18(21-25-26)19-22-23-20-27(19)24-17(12-28-20)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3 |
| InChIKey | IABBMNXBUWAAQX-UHFFFAOYSA-N |
| Molecular Weight | 387.465 g/mol |
| SMILES | c1([n]2c(nn1)SCC(=N2)c1ccccc1)-c1nn[n](c1C)-c1ccc(cc1)C |
| SPLASH | splash10-0gdl-7910000000-d6e9d34232fcf8ce8368 |
| Source of Spectrum | QA-47-543-6 |
| Synonyms | 3-(5-Methyl-1-p-tolyl-1H-1,2,3-triazol-4-yl)-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine 7H-3-[5-Methyl-1-(4-methylphenyl)-1,2,3-triazol-4-yl]-6-phenyl-s-triazolo[3,4-b]-1,3,4-thiadiazine 3-[5-methyl-1-(4-methylphenyl)-4-triazolyl]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine 3-[5-methyl-1-(4-methylphenyl)triazol-4-yl]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine 3-(5-Methyl-1-(p-tolyl)-1H-1,2,3-triazol-4-yl)-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine 3-[5-methyl-1-(4-methylphenyl)-1,2,3-triazol-4-yl]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine |
| Wiley ID | 863542 |