2-[4-[4-(phenylsulfonyl)piperazin-1-yl]carbonylphenyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-(phenylsulfonyl)piperazin-1-yl]carbonylphenyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(benzenesulfonyl)piperazine-1-carbonyl]phenyl]isoindoline-1,3-dione CAS Name: 2-[4-[[4-(benzenesulfonyl)-1-piperazinyl]-oxomethyl]phenyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(benzenesulfonyl)piperazine-1-carbonyl]phenyl]isoindole-1,3-dione Traditional Name: 2-[4-(4-besylpiperazine-1-carbonyl)phenyl]isoindoline-1,3-quinone Formula: C25H21N3O5S MolecularWeight: 475.51634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H21N3O5S/c29-23(26-14-16-27(17-15-26)34(32,33)20-6-2-1-3-7-20)18-10-12-19(13-11-18)28-24(30)21-8-4-5-9-22(21)25(28)31/h1-13H,14-17H2