4-butyl-1-(4-methylphenyl)-2-(4-methylsulfonylphenyl)pyrazolidine-3,5-dione

Systemtic Name: 4-butyl-1-(4-methylphenyl)-2-(4-methylsulfonylphenyl)pyrazolidine-3,5-dione Openeye Name: 4-butyl-1-(4-methylsulfonylphenyl)-2-(p-tolyl)pyrazolidine-3,5-dione CAS Name: 4-butyl-1-(4-methylphenyl)-2-(4-methylsulfonylphenyl)pyrazolidine-3,5-dione IUPAC Name: 4-butyl-1-(4-methylphenyl)-2-(4-methylsulfonylphenyl)pyrazolidine-3,5-dione Traditional Name: 4-butyl-1-(4-mesylphenyl)-2-(p-tolyl)pyrazolidine-3,5-quinone Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)N(N(C1=O)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCC1C(=O)N(N(C1=O)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H24N2O4S/c1-4-5-6-19-20(24)22(16-9-7-15(2)8-10-16)23(21(19)25)17-11-13-18(14-12-17)28(3,26)27/h7-14,19H,4-6H2,1-3H3