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CHEBI:111225 - 3-[[[4-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]methyl]-1,2,3-benzotriazin-4-one

ChEBI IDCHEBI:111225
ChEBI Name3-[[[4-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]methyl]-1,2,3-benzotriazin-4-one
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FormulaC21H16N6OS2
Net Charge0
Average Mass432.534
Monoisotopic Mass432.08270
SMILESO=c1c2ccccc2nnn1CSc1nnc(-c2cccs2)n1Cc1ccccc1
InChIInChI=1S/C21H16N6OS2/c28-20-16-9-4-5-10-17(16)22-25-27(20)14-30-21-24-23-19(18-11-6-12-29-18)26(21)13-15-7-2-1-3-8-15/h1-12H,13-14H2
InChIKeyJAJRLWYJKXCGAY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[[[4-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]methyl]-1,2,3-benzotriazin-4-one (CHEBI:111225) is a benzotriazines (CHEBI:51361)
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