2-(3-chlorophenyl)-4-[3-(dimethylamino)phenoxy]-5-(4-methylsulfonylphenyl)pyridazin-3-one

Systemtic Name: 2-(3-chlorophenyl)-4-[3-(dimethylamino)phenoxy]-5-(4-methylsulfonylphenyl)pyridazin-3-one Openeye Name: 2-(3-chlorophenyl)-4-[3-(dimethylamino)phenoxy]-5-(4-methylsulfonylphenyl)pyridazin-3-one CAS Name: 2-(3-chlorophenyl)-4-[3-(dimethylamino)phenoxy]-5-(4-methylsulfonylphenyl)-3-pyridazinone IUPAC Name: 2-(3-chlorophenyl)-4-[3-(dimethylamino)phenoxy]-5-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 2-(3-chlorophenyl)-4-[3-(dimethylamino)phenoxy]-5-(4-mesylphenyl)pyridazin-3-one Formula: C25H22ClN3O4S MolecularWeight: 495.97788

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=CC=C1)OC2=C(C=NN(C2=O)C3=CC(=CC=C3)Cl)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CN(C)C1=CC(=CC=C1)OC2=C(C=NN(C2=O)C3=CC(=CC=C3)Cl)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C25H22ClN3O4S/c1-28(2)19-7-5-9-21(15-19)33-24-23(17-10-12-22(13-11-17)34(3,31)32)16-27-29(25(24)30)20-8-4-6-18(26)14-20/h4-16H,1-3H3