2-(3-chlorophenyl)-4-[(2-methylpropan-2-yl)oxy]-5-(4-methylsulfonylphenyl)pyridazin-3-one

Systemtic Name: 2-(3-chlorophenyl)-4-[(2-methylpropan-2-yl)oxy]-5-(4-methylsulfonylphenyl)pyridazin-3-one Openeye Name: 4-tert-butoxy-2-(3-chlorophenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one CAS Name: 2-(3-chlorophenyl)-4-[(2-methylpropan-2-yl)oxy]-5-(4-methylsulfonylphenyl)-3-pyridazinone IUPAC Name: 2-(3-chlorophenyl)-4-[(2-methylpropan-2-yl)oxy]-5-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 4-tert-butoxy-2-(3-chlorophenyl)-5-(4-mesylphenyl)pyridazin-3-one Formula: C21H21ClN2O4S MolecularWeight: 432.92044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=C(C=NN(C1=O)C2=CC(=CC=C2)Cl)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC1=C(C=NN(C1=O)C2=CC(=CC=C2)Cl)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H21ClN2O4S/c1-21(2,3)28-19-18(14-8-10-17(11-9-14)29(4,26)27)13-23-24(20(19)25)16-7-5-6-15(22)12-16/h5-13H,1-4H3