4-(4-fluorophenyl)-5-(4-methylperoxysulfanylphenyl)-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 4-(4-fluorophenyl)-5-(4-methylperoxysulfanylphenyl)-2-(phenylmethyl)pyridazin-3-one Openeye Name: 2-benzyl-4-(4-fluorophenyl)-5-(4-methylperoxysulfanylphenyl)pyridazin-3-one CAS Name: 4-[5-(4-fluorophenyl)-6-oxo-1-(phenylmethyl)-4-pyridazinyl]benzenesulfenic acid methoxy ester IUPAC Name: 2-benzyl-4-(4-fluorophenyl)-5-(4-methylperoxysulfanylphenyl)pyridazin-3-one Traditional Name: 2-benzyl-4-(4-fluorophenyl)-5-[4-(methylperoxythio)phenyl]pyridazin-3-one Formula: C24H19FN2O3S MolecularWeight: 434.482663

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Descriptors Computed from Structure

Canonical SMILES:

COOSC1=CC=C(C=C1)C2=C(C(=O)N(N=C2)CC3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

COOSC1=CC=C(C=C1)C2=C(C(=O)N(N=C2)CC3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H19FN2O3S/c1-29-30-31-21-13-9-18(10-14-21)22-15-26-27(16-17-5-3-2-4-6-17)24(28)23(22)19-7-11-20(25)12-8-19/h2-15H,16H2,1H3