2-methyl-5-(4-methylsulfonylphenyl)-4-phenyl-pyridazin-3-one

Systemtic Name: 2-methyl-5-(4-methylsulfonylphenyl)-4-phenyl-pyridazin-3-one Openeye Name: 2-methyl-5-(4-methylsulfonylphenyl)-4-phenyl-pyridazin-3-one CAS Name: 2-methyl-5-(4-methylsulfonylphenyl)-4-phenyl-3-pyridazinone IUPAC Name: 2-methyl-5-(4-methylsulfonylphenyl)-4-phenylpyridazin-3-one Traditional Name: 5-(4-mesylphenyl)-2-methyl-4-phenyl-pyridazin-3-one Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(C=N1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3

Isomeric SMILES

CN1C(=O)C(=C(C=N1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C18H16N2O3S/c1-20-18(21)17(14-6-4-3-5-7-14)16(12-19-20)13-8-10-15(11-9-13)24(2,22)23/h3-12H,1-2H3