4-[3-(4-methoxyphenyl)-2-methyl-4-methylsulfonyl-phenyl]carbonyl-2-propan-2-yl-1H-pyrazol-3-one

Systemtic Name: 4-[3-(4-methoxyphenyl)-2-methyl-4-methylsulfonyl-phenyl]carbonyl-2-propan-2-yl-1H-pyrazol-3-one Openeye Name: 2-isopropyl-4-[3-(4-methoxyphenyl)-2-methyl-4-methylsulfonyl-benzoyl]-1H-pyrazol-3-one CAS Name: 4-[[3-(4-methoxyphenyl)-2-methyl-4-methylsulfonylphenyl]-oxomethyl]-2-propan-2-yl-1H-pyrazol-3-one IUPAC Name: 4-[3-(4-methoxyphenyl)-2-methyl-4-methylsulfonylbenzoyl]-2-propan-2-yl-1H-pyrazol-3-one Traditional Name: 2-isopropyl-4-[4-mesyl-3-(4-methoxyphenyl)-2-methyl-benzoyl]-3-pyrazolin-3-one Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C2=CC=C(C=C2)OC)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1C2=CC=C(C=C2)OC)S(=O)(=O)C)C(=O)C3=CNN(C3=O)C(C)C

InChI

InChI=1S/C22H24N2O5S/c1-13(2)24-22(26)18(12-23-24)21(25)17-10-11-19(30(5,27)28)20(14(17)3)15-6-8-16(29-4)9-7-15/h6-13,23H,1-5H3