3-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-(phenylmethyl)pyrrolidine-2,5-dione

Systemtic Name: 3-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-(phenylmethyl)pyrrolidine-2,5-dione Openeye Name: 1-benzyl-3-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]pyrrolidine-2,5-dione CAS Name: 3-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-1-(phenylmethyl)pyrrolidine-2,5-dione IUPAC Name: 1-benzyl-3-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]pyrrolidine-2,5-dione Traditional Name: 1-benzyl-3-[4-(3,4-dimethylphenyl)sulfonylpiperazino]pyrrolidine-2,5-quinone Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3CC(=O)N(C3=O)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3CC(=O)N(C3=O)CC4=CC=CC=C4)C

InChI

InChI=1S/C23H27N3O4S/c1-17-8-9-20(14-18(17)2)31(29,30)25-12-10-24(11-13-25)21-15-22(27)26(23(21)28)16-19-6-4-3-5-7-19/h3-9,14,21H,10-13,15-16H2,1-2H3