1,2-dimethyl-4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)pyrazol-3-one

Systemtic Name: 1,2-dimethyl-4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)pyrazol-3-one Openeye Name: 1,2-dimethyl-5-(4-methylsulfonylphenyl)-4-(p-tolyl)pyrazol-3-one CAS Name: 1,2-dimethyl-4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-3-pyrazolone IUPAC Name: 1,2-dimethyl-4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)pyrazol-3-one Traditional Name: 5-(4-mesylphenyl)-1,2-dimethyl-4-(p-tolyl)-3-pyrazolin-3-one Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N(N(C2=O)C)C)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N(N(C2=O)C)C)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C19H20N2O3S/c1-13-5-7-14(8-6-13)17-18(20(2)21(3)19(17)22)15-9-11-16(12-10-15)25(4,23)24/h5-12H,1-4H3