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CHEBI:748400 - pittsburgh compound b unlabelled

Default Structure
ChEBI IDCHEBI:748400
ChEBI Namepittsburgh compound b unlabelled
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC14H12N2OS
Net Charge0
Average Mass256.330
Monoisotopic Mass256.06703
SMILESCNc1ccc(-c2nc3ccc(O)cc3s2)cc1
InChIInChI=1S/C14H12N2OS/c1-15-10-4-2-9(3-5-10)14-16-12-7-6-11(17)8-13(12)18-14/h2-8,15,17H,1H3
InChIKeyZQAQXZBSGZUUNL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
pittsburgh compound b unlabelled (CHEBI:748400) is a benzothiazoles (CHEBI:37947)
Citations