5-(3-fluoranyl-4-methylsulfanyl-phenyl)-4-methoxy-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 5-(3-fluoranyl-4-methylsulfanyl-phenyl)-4-methoxy-2-(phenylmethyl)pyridazin-3-one Openeye Name: 2-benzyl-5-(3-fluoro-4-methylsulfanyl-phenyl)-4-methoxy-pyridazin-3-one CAS Name: 5-[3-fluoro-4-(methylthio)phenyl]-4-methoxy-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 2-benzyl-5-(3-fluoro-4-methylsulfanylphenyl)-4-methoxypyridazin-3-one Traditional Name: 2-benzyl-5-[3-fluoro-4-(methylthio)phenyl]-4-methoxy-pyridazin-3-one Formula: C19H17FN2O2S MolecularWeight: 356.413883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=NN(C1=O)CC2=CC=CC=C2)C3=CC(=C(C=C3)SC)F

Isomeric SMILES

COC1=C(C=NN(C1=O)CC2=CC=CC=C2)C3=CC(=C(C=C3)SC)F

InChI

InChI=1S/C19H17FN2O2S/c1-24-18-15(14-8-9-17(25-2)16(20)10-14)11-21-22(19(18)23)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3