4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-(oxan-2-yl)pyridazin-3-one

Systemtic Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-(oxan-2-yl)pyridazin-3-one Openeye Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-tetrahydropyran-2-yl-pyridazin-3-one CAS Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-(2-oxanyl)-3-pyridazinone IUPAC Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-(oxan-2-yl)pyridazin-3-one Traditional Name: 4-(4-fluorophenyl)-5-(4-mesylphenyl)-2-tetrahydropyran-2-yl-pyridazin-3-one Formula: C22H21FN2O4S MolecularWeight: 428.476543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C3CCCCO3)C4=CC=C(C=C4)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C3CCCCO3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H21FN2O4S/c1-30(27,28)18-11-7-15(8-12-18)19-14-24-25(20-4-2-3-13-29-20)22(26)21(19)16-5-9-17(23)10-6-16/h5-12,14,20H,2-4,13H2,1H3