4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-(4-phenoxyphenyl)pyridazin-3-one

Systemtic Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-(4-phenoxyphenyl)pyridazin-3-one Openeye Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-(4-phenoxyphenyl)pyridazin-3-one CAS Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-(4-phenoxyphenyl)-3-pyridazinone IUPAC Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-(4-phenoxyphenyl)pyridazin-3-one Traditional Name: 4-(4-fluorophenyl)-5-(4-mesylphenyl)-2-(4-phenoxyphenyl)pyridazin-3-one Formula: C29H21FN2O4S MolecularWeight: 512.551443

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C3=CC=C(C=C3)OC4=CC=CC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C3=CC=C(C=C3)OC4=CC=CC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C29H21FN2O4S/c1-37(34,35)26-17-9-20(10-18-26)27-19-31-32(29(33)28(27)21-7-11-22(30)12-8-21)23-13-15-25(16-14-23)36-24-5-3-2-4-6-24/h2-19H,1H3