![2,6-Bis([5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl)-3-nitropyridine](/api/spectrum/1Isd8fTPUQ6/structure.png?h=300&w=458 "2,6-Bis([5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl)-3-nitropyridine")
| SpectraBase Compound ID | L7u3S4uSibY |
|---|---|
| InChI | InChI=1S/C11H8N6O2S6/c1-20-8-13-15-10(24-8)22-6-4-3-5(17(18)19)7(12-6)23-11-16-14-9(21-2)25-11/h3-4H,1-2H3 |
| InChIKey | MJBUERUTLOXEPI-UHFFFAOYSA-N |
| Mol Weight | 448.6 g/mol |
| Molecular Formula | C11H8N6O2S6 |
| Exact Mass | 447.903301 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1Isd8fTPUQ6 |
|---|---|
| Name | 2,6-Bis([5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl)-3-nitropyridine |
| CAS Registry Number | 98618-45-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H8N6O2S6 |
| InChI | InChI=1S/C11H8N6O2S6/c1-20-8-13-15-10(24-8)22-6-4-3-5(17(18)19)7(12-6)23-11-16-14-9(21-2)25-11/h3-4H,1-2H3 |
| InChIKey | MJBUERUTLOXEPI-UHFFFAOYSA-N |
| Molecular Weight | 448.585 g/mol |
| SMILES | CSc1nnc(s1)Sc1ccc(c(n1)Sc1nnc(s1)SC)N(=O)=O |
| SPLASH | splash10-002g-9410000000-dacec6ecb84db557a455 |
| Source of Spectrum | O-20-396-12 |
| Synonyms | 2,6-Bis(5-methylthio-1,3,4-thiadiazole-2-ylthio)-3-nitro-pyridine 2-(methylthio)-5-[[6-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]-5-nitro-2-pyridinyl]thio]-1,3,4-thiadiazole 2-(methylthio)-5-[[6-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]-5-nitro-2-pyridyl]thio]-1,3,4-thiadiazole 2-Methylsulfanyl-5-[6-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-5-nitro-pyridin-2-yl]sulfanyl-1,3,4-thiadiazole 2-Methylsulfanyl-5-[[6-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-5-nitro-2-pyridyl]sulfanyl]-1,3,4-thiadiazole |
| Wiley ID | 1387021 |