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4-Bromo-N-(3-(1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzamide
SpectraBase Compound ID D3ovrsge46l
InChI InChI=1S/C19H12BrClN8OS/c1-10-15(23-27-28(10)14-8-6-13(21)7-9-14)16-24-25-19-29(16)26-18(31-19)22-17(30)11-2-4-12(20)5-3-11/h2-9H,1H3,(H,22,26,30)
InChIKey BZMNJNYDWVLDTA-UHFFFAOYSA-N
Mol Weight 515.78 g/mol
Molecular Formula C19H12BrClN8OS
Exact Mass 513.972669 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3EJ5HmZMVzS
Name 4-Bromo-N-(3-(1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzamide
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Formula C19H12BrClN8OS
InChI InChI=1S/C19H12BrClN8OS/c1-10-15(23-27-28(10)14-8-6-13(21)7-9-14)16-24-25-19-29(16)26-18(31-19)22-17(30)11-2-4-12(20)5-3-11/h2-9H,1H3,(H,22,26,30)
InChIKey BZMNJNYDWVLDTA-UHFFFAOYSA-N
Molecular Weight 515.777 g/mol
SMILES N(C1=N[n]2c(nnc2-c2c([n](nn2)-c2ccc(cc2)Cl)C)S1)C(c1ccc(cc1)Br)=O
SPLASH splash10-001i-1910100000-4b5af877b2fa3cf78e15
Source of Spectrum Y1-39B-781-4b
Wiley ID 1743971