1-(2,6-dimethylphenyl)-3-[4-(phenylsulfonyl)piperazin-1-yl]pyrrolidine-2,5-dione

Systemtic Name: 1-(2,6-dimethylphenyl)-3-[4-(phenylsulfonyl)piperazin-1-yl]pyrrolidine-2,5-dione Openeye Name: 3-[4-(benzenesulfonyl)piperazin-1-yl]-1-(2,6-dimethylphenyl)pyrrolidine-2,5-dione CAS Name: 3-[4-(benzenesulfonyl)-1-piperazinyl]-1-(2,6-dimethylphenyl)pyrrolidine-2,5-dione IUPAC Name: 3-[4-(benzenesulfonyl)piperazin-1-yl]-1-(2,6-dimethylphenyl)pyrrolidine-2,5-dione Traditional Name: 3-(4-besylpiperazino)-1-(2,6-dimethylphenyl)pyrrolidine-2,5-quinone Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=O)CC(C2=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)CC(C2=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H25N3O4S/c1-16-7-6-8-17(2)21(16)25-20(26)15-19(22(25)27)23-11-13-24(14-12-23)30(28,29)18-9-4-3-5-10-18/h3-10,19H,11-15H2,1-2H3