4-(2-methoxypyridin-3-yl)-5-(4-methylsulfonylphenyl)-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 4-(2-methoxypyridin-3-yl)-5-(4-methylsulfonylphenyl)-2-(phenylmethyl)pyridazin-3-one Openeye Name: 2-benzyl-4-(2-methoxy-3-pyridyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one CAS Name: 4-(2-methoxy-3-pyridinyl)-5-(4-methylsulfonylphenyl)-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 2-benzyl-4-(2-methoxypyridin-3-yl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 2-benzyl-5-(4-mesylphenyl)-4-(2-methoxy-3-pyridyl)pyridazin-3-one Formula: C24H21N3O4S MolecularWeight: 447.50624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)C2=C(C=NN(C2=O)CC3=CC=CC=C3)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=CC=N1)C2=C(C=NN(C2=O)CC3=CC=CC=C3)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C24H21N3O4S/c1-31-23-20(9-6-14-25-23)22-21(18-10-12-19(13-11-18)32(2,29)30)15-26-27(24(22)28)16-17-7-4-3-5-8-17/h3-15H,16H2,1-2H3