1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-4-phenyl-butane-1,4-dione

Systemtic Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-4-phenyl-butane-1,4-dione Openeye Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-4-phenyl-butane-1,4-dione CAS Name: 1-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-4-phenylbutane-1,4-dione IUPAC Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-4-phenylbutane-1,4-dione Traditional Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazino]-4-phenyl-butane-1,4-dione Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C22H26N2O4S/c1-17-8-10-21(18(2)16-17)29(27,28)24-14-12-23(13-15-24)22(26)11-9-20(25)19-6-4-3-5-7-19/h3-8,10,16H,9,11-15H2,1-2H3