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6-(4-fluorophenyl)-3-[5-methyl-1-(4-methylphenyl)triazol-4-yl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
SpectraBase Compound ID IH3g2ZdfP0P
InChI InChI=1S/C19H14FN7S/c1-11-3-9-15(10-4-11)26-12(2)16(21-25-26)17-22-23-19-27(17)24-18(28-19)13-5-7-14(20)8-6-13/h3-10H,1-2H3
InChIKey JWDGKHCIGOQGHN-UHFFFAOYSA-N
Mol Weight 391.43 g/mol
Molecular Formula C19H14FN7S
Exact Mass 391.101543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6WaUPp79m4G
Name 3-[5-Methyl-1-(4-methylphenyl)-1,2,3-triazol-4-yl]-6-(p-fluorophenyl)-1,3,4-triazolo[3,4-b]-1,3,4-thiadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H14FN7S
InChI InChI=1S/C19H14FN7S/c1-11-3-9-15(10-4-11)26-12(2)16(21-25-26)17-22-23-19-27(17)24-18(28-19)13-5-7-14(20)8-6-13/h3-10H,1-2H3
InChIKey JWDGKHCIGOQGHN-UHFFFAOYSA-N
Molecular Weight 391.428 g/mol
SMILES c1([n]2c(nn1)SC(=N2)c1ccc(cc1)F)-c1nn[n](c1C)-c1ccc(cc1)C
SPLASH splash10-02tc-8922000000-4ad35d5194ccff126bc6
Source of Spectrum QA-48-345-6
Synonyms 3-[5-Methyl-1-(4-methylphenyl)-1,2,3-triazol-4-yl]-6-(p-fluorophenyl)-1,2,4-triazolo[3,4-b]-1,3,4-thiadiazole 6-(4-fluorophenyl)-3-[5-methyl-1-(4-methylphenyl)-4-triazolyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole 6-(4-fluorophenyl)-3-[5-methyl-1-(4-methylphenyl)triazol-4-yl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole 6-(4-fluorophenyl)-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 863462