CAS
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Specification
The molecular formula is C11H8N4O.
The molecular weight is 212.21 g/mol.
The compound was created on August 8, 2005.
The compound was last modified on November 25, 2023.
The IUPAC name is 6-phenyl-5H-[1,2,4]triazolo[4,3-b]pyridazin-8-one.
The InChI is InChI=1S/C11H8N4O/c16-10-6-9(8-4-2-1-3-5-8)14-15-7-12-13-11(10)15/h1-7,14H.
The InChIKey is CXZFEQORZDGYOV-UHFFFAOYSA-N.
The canonical SMILES is C1=CC=C(C=C1)C2=CC(=O)C3=NN=CN3N2.
The CAS number is 18591-71-4.
The ChEMBL ID is CHEMBL1700921.