3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-phenethyl-pyrrolidine-2,5-dione

Systemtic Name: 3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-phenethyl-pyrrolidine-2,5-dione Openeye Name: 1-phenethyl-3-[4-(p-tolylsulfonyl)piperazin-1-yl]pyrrolidine-2,5-dione CAS Name: 3-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-phenethylpyrrolidine-2,5-dione IUPAC Name: 3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-phenethylpyrrolidine-2,5-dione Traditional Name: 1-phenethyl-3-(4-tosylpiperazino)pyrrolidine-2,5-quinone Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3CC(=O)N(C3=O)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3CC(=O)N(C3=O)CCC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O4S/c1-18-7-9-20(10-8-18)31(29,30)25-15-13-24(14-16-25)21-17-22(27)26(23(21)28)12-11-19-5-3-2-4-6-19/h2-10,21H,11-17H2,1H3