4-(3-fluoranyl-4-methylsulfanyl-phenyl)-5-(3-methylbutyl)-1H-pyridazin-6-one

Systemtic Name: 4-(3-fluoranyl-4-methylsulfanyl-phenyl)-5-(3-methylbutyl)-1H-pyridazin-6-one Openeye Name: 4-(3-fluoro-4-methylsulfanyl-phenyl)-5-isopentyl-1H-pyridazin-6-one CAS Name: 4-[3-fluoro-4-(methylthio)phenyl]-5-(3-methylbutyl)-1H-pyridazin-6-one IUPAC Name: 4-(3-fluoro-4-methylsulfanylphenyl)-5-(3-methylbutyl)-1H-pyridazin-6-one Traditional Name: 4-[3-fluoro-4-(methylthio)phenyl]-5-isoamyl-1H-pyridazin-6-one Formula: C16H19FN2OS MolecularWeight: 306.398263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=C(C=NNC1=O)C2=CC(=C(C=C2)SC)F

Isomeric SMILES

CC(C)CCC1=C(C=NNC1=O)C2=CC(=C(C=C2)SC)F

InChI

InChI=1S/C16H19FN2OS/c1-10(2)4-6-12-13(9-18-19-16(12)20)11-5-7-15(21-3)14(17)8-11/h5,7-10H,4,6H2,1-3H3,(H,19,20)