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

Systemtic Name: 2-[4-(4-phenylpiperazin-1-yl)sulfonylphenyl]isoindole-1,3-dione Openeye Name: 2-[4-(4-phenylpiperazin-1-yl)sulfonylphenyl]isoindoline-1,3-dione CAS Name: 2-[4-[(4-phenyl-1-piperazinyl)sulfonyl]phenyl]isoindole-1,3-dione IUPAC Name: 2-[4-(4-phenylpiperazin-1-yl)sulfonylphenyl]isoindole-1,3-dione Traditional Name: 2-[4-(4-phenylpiperazino)sulfonylphenyl]isoindoline-1,3-quinone Formula: C24H21N3O4S MolecularWeight: 447.50624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C24H21N3O4S/c28-23-21-8-4-5-9-22(21)24(29)27(23)19-10-12-20(13-11-19)32(30,31)26-16-14-25(15-17-26)18-6-2-1-3-7-18/h1-13H,14-17H2