4-(2-methoxyphenyl)-5-(4-methylsulfonylphenyl)-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 4-(2-methoxyphenyl)-5-(4-methylsulfonylphenyl)-2-(phenylmethyl)pyridazin-3-one Openeye Name: 2-benzyl-4-(2-methoxyphenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one CAS Name: 4-(2-methoxyphenyl)-5-(4-methylsulfonylphenyl)-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 2-benzyl-4-(2-methoxyphenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 2-benzyl-5-(4-mesylphenyl)-4-(2-methoxyphenyl)pyridazin-3-one Formula: C25H22N2O4S MolecularWeight: 446.51818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=C(C=NN(C2=O)CC3=CC=CC=C3)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC=C1C2=C(C=NN(C2=O)CC3=CC=CC=C3)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C25H22N2O4S/c1-31-23-11-7-6-10-21(23)24-22(19-12-14-20(15-13-19)32(2,29)30)16-26-27(25(24)28)17-18-8-4-3-5-9-18/h3-16H,17H2,1-2H3