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6-[1-(3-bromophenyl)-5-methyl-1,2,3-triazol-4-yl]-3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
SpectraBase Compound ID 9pNm0HCCXOq
InChI InChI=1S/C17H11BrN8S/c1-10-14(20-24-25(10)13-4-2-3-12(18)9-13)16-23-26-15(21-22-17(26)27-16)11-5-7-19-8-6-11/h2-9H,1H3
InChIKey HUXRLCXGAMCTFN-UHFFFAOYSA-N
Mol Weight 439.3 g/mol
Molecular Formula C17H11BrN8S
Exact Mass 438.001077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ki7C2ygLyGh
Name 6-[1-(3-bromophenyl)-5-methyl-1,2,3-triazol-4-yl]-3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
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Formula C17H11BrN8S
InChI InChI=1S/C17H11BrN8S/c1-10-14(20-24-25(10)13-4-2-3-12(18)9-13)16-23-26-15(21-22-17(26)27-16)11-5-7-19-8-6-11/h2-9H,1H3
InChIKey HUXRLCXGAMCTFN-UHFFFAOYSA-N
Molecular Weight 439.295 g/mol
SMILES c12[n](N=C(S2)c2nn[n](c2C)-c2cc(Br)ccc2)c(nn1)-c1ccncc1
SPLASH splash10-0pel-2903700000-d92a3b297201f2a1eb44
Source of Spectrum Y1-38-381-3
Synonyms 6-[1-(3-bromophenyl)-5-methyl-4-triazolyl]-3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole 6-[1-(3-bromophenyl)-5-methyl-triazol-4-yl]-3-(4-pyridyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole 6-[1-(3-bromophenyl)-5-methyltriazol-4-yl]-3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Wiley ID 1527654