5-(4-fluorophenyl)-3-methyl-4-(4-methylperoxysulfanylphenyl)-1H-pyridazin-6-one

Systemtic Name: 5-(4-fluorophenyl)-3-methyl-4-(4-methylperoxysulfanylphenyl)-1H-pyridazin-6-one Openeye Name: 5-(4-fluorophenyl)-3-methyl-4-(4-methylperoxysulfanylphenyl)-1H-pyridazin-6-one CAS Name: 4-[5-(4-fluorophenyl)-3-methyl-6-oxo-1H-pyridazin-4-yl]benzenesulfenic acid methoxy ester IUPAC Name: 5-(4-fluorophenyl)-3-methyl-4-(4-methylperoxysulfanylphenyl)-1H-pyridazin-6-one Traditional Name: 5-(4-fluorophenyl)-3-methyl-4-[4-(methylperoxythio)phenyl]-1H-pyridazin-6-one Formula: C18H15FN2O3S MolecularWeight: 358.386703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=O)C(=C1C2=CC=C(C=C2)SOOC)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NNC(=O)C(=C1C2=CC=C(C=C2)SOOC)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H15FN2O3S/c1-11-16(12-5-9-15(10-6-12)25-24-23-2)17(18(22)21-20-11)13-3-7-14(19)8-4-13/h3-10H,1-2H3,(H,21,22)