CHEBI:80011 - B 823-08

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ChEBI Name B 823-08 ChEBI ID CHEBI:80011 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C16H14F3N3OS Net Charge 0 Average Mass 353.36200 Monoisotopic Mass 353.08097 InChI InChI=1S/C16H14F3N3OS/c1-9-13(20-6-5-14(9)23-2)8-24-15-21-11-4-3-10(16(17,18)19)7-12(11)22-15/h3-7H,8H2,1-2H3,(H,21,22) InChIKey CEXGUUCQSXKHRS-UHFFFAOYSA-N SMILES COc1ccnc(CSc2nc3cc(ccc3[nH]2)C(F)(F)F)c1C ChEBI Ontology Outgoing B 823-08 (CHEBI:80011) is a aromatic ether (CHEBI:35618) Manual Xref Database C15664 KEGG COMPOUND View more database links Registry Number Type Source 86604-69-5 CAS Registry Number KEGG COMPOUND