2-[4-[4-(phenylcarbonyl)piperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-(phenylcarbonyl)piperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione Openeye Name: 2-[4-(4-benzoylpiperazin-1-yl)sulfonylphenyl]isoindoline-1,3-dione CAS Name: 2-[4-[(4-benzoyl-1-piperazinyl)sulfonyl]phenyl]isoindole-1,3-dione IUPAC Name: 2-[4-(4-benzoylpiperazin-1-yl)sulfonylphenyl]isoindole-1,3-dione Traditional Name: 2-[4-(4-benzoylpiperazino)sulfonylphenyl]isoindoline-1,3-quinone Formula: C25H21N3O5S MolecularWeight: 475.51634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

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