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6-((2,4-dichlorophenoxy)methyl)-3-(5-methyl-1-(p-tolyl)-1H-1,2,3-triazol-4-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

View entire compound with spectra: 1 MS (GC)

6-((2,4-dichlorophenoxy)methyl)-3-(5-methyl-1-(p-tolyl)-1H-1,2,3-triazol-4-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
SpectraBase Compound ID Jy4BZRE5R6S
InChI InChI=1S/C20H15Cl2N7OS/c1-11-3-6-14(7-4-11)28-12(2)18(23-27-28)19-24-25-20-29(19)26-17(31-20)10-30-16-8-5-13(21)9-15(16)22/h3-9H,10H2,1-2H3
InChIKey OYJWGFCCUJKYQY-UHFFFAOYSA-N
Mol Weight 472.35 g/mol
Molecular Formula C20H15Cl2N7OS
Exact Mass 471.043585 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jv7teSPrvQr
Name 6-((2,4-dichlorophenoxy)methyl)-3-(5-methyl-1-(p-tolyl)-1H-1,2,3-triazol-4-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
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Formula C20H15Cl2N7OS
InChI InChI=1S/C20H15Cl2N7OS/c1-11-3-6-14(7-4-11)28-12(2)18(23-27-28)19-24-25-20-29(19)26-17(31-20)10-30-16-8-5-13(21)9-15(16)22/h3-9H,10H2,1-2H3
InChIKey OYJWGFCCUJKYQY-UHFFFAOYSA-N
Molecular Weight 472.354 g/mol
SMILES c1([n]2N=C(Sc2nn1)COc1ccc(cc1Cl)Cl)-c1nn[n](-c2ccc(cc2)C)c1C
SPLASH splash10-01c3-4950000000-ccdcfe2954fb1923cbf0
Source of Spectrum Y1-41B-1954-6a
Synonyms 6-[(2,4-dichlorophenoxy)methyl]-3-[5-methyl-1-(4-methylphenyl)-4-triazolyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole 6-[(2,4-dichlorophenoxy)methyl]-3-[5-methyl-1-(4-methylphenyl)triazol-4-yl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole 6-[[2,4-bis(chloranyl)phenoxy]methyl]-3-[5-methyl-1-(4-methylphenyl)-1,2,3-triazol-4-yl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Wiley ID 1744170