SpectraBase Compound ID | 8s1Ptphuqbs |
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InChI | InChI=1S/C7H7ClN4S/c1-4-3-5(8)12-6(9-4)10-7(11-12)13-2/h3H,1-2H3 |
InChIKey | QEFWPDVSBZHJOK-UHFFFAOYSA-N |
Mol Weight | 214.67 g/mol |
Molecular Formula | C7H7ClN4S |
Exact Mass | 214.007995 g/mol |
SpectraBase Spectrum ID | Eq8wMnRv2u1 |
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Name | 5-Chloro-7-methyl-2-methylthio-1,2,4-triazolo[1,5-a]pyrimidine |
Comments | Less than 3 mono-isotopic peaks |
Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C7H7ClN4S |
InChI | InChI=1S/C7H7ClN4S/c1-4-3-5(8)12-6(9-4)10-7(11-12)13-2/h3H,1-2H3 |
InChIKey | QEFWPDVSBZHJOK-UHFFFAOYSA-N |
Molecular Weight | 214.674 g/mol |
SMILES | c12[n](nc(n2)SC)C(=CC(=N1)C)Cl |
SPLASH | splash10-02t9-0490000000-e431d02608a7fe2c0558 |
Source of Spectrum | Y-34-1521-4 |
Synonyms | 5-chloranyl-7-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine 5-chloro-7-methyl-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine 5-chloro-7-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl methyl sulfide 7-Chloro-5-methyl-2-methylthio-1,2,4-triazolo[1,5-a]pyrimidine 7-chloro-5-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine 7-chloranyl-5-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine |
Wiley ID | 1212954 |