4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-(1-phenylprop-2-ynyl)pyridazin-3-one

Systemtic Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-(1-phenylprop-2-ynyl)pyridazin-3-one Openeye Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-(1-phenylprop-2-ynyl)pyridazin-3-one CAS Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-(1-phenylprop-2-ynyl)-3-pyridazinone IUPAC Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-(1-phenylprop-2-ynyl)pyridazin-3-one Traditional Name: 4-(4-fluorophenyl)-5-(4-mesylphenyl)-2-(1-phenylprop-2-ynyl)pyridazin-3-one Formula: C26H19FN2O3S MolecularWeight: 458.504063

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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)C(C#C)C3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

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

InChI

InChI=1S/C26H19FN2O3S/c1-3-24(19-7-5-4-6-8-19)29-26(30)25(20-9-13-21(27)14-10-20)23(17-28-29)18-11-15-22(16-12-18)33(2,31)32/h1,4-17,24H,2H3