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CHEBI:41032 - 5-methyl[1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ium

ChEBI IDCHEBI:41032
ChEBI Name5-methyl[1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ium
Stars
ASCII Name5-methyl[1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ium
Last Modified10 November 2014
DownloadsMolfile
FormulaC9H8N3S
Net Charge+1
Average Mass190.251
Monoisotopic Mass190.04334
SMILES[H]c1c([H])c(C([H])([H])[H])c2c(sc3n2c([H])n[n+]3[H])c1[H]
InChIInChI=1S/C9H7N3S/c1-6-3-2-4-7-8(6)12-5-10-11-9(12)13-7/h2-5H,1H3/p+1
InChIKeyDQJCHOQLCLEDLL-UHFFFAOYSA-O
ChEBI Ontology
Outgoing Relation(s)
5-methyl[1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ium (CHEBI:41032) is a organic cation (CHEBI:25697)
5-methyl[1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ium (CHEBI:41032) is conjugate acid of tricyclazole (CHEBI:81783)
Incoming Relation(s)
tricyclazole (CHEBI:81783) is conjugate base of 5-methyl[1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ium (CHEBI:41032)
Synonyms  Source
5-METHYL-1,2,4-TRIAZOLO[3,4-B]BENZOTHIAZOLEPDBeChem
5-methyl[1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-iumPDBeChem
Manual XrefsDatabases
BEAPDBeChem