1-(3-chlorophenyl)-3-[4-(phenylsulfonyl)piperazin-1-yl]pyrrole-2,5-dione

Systemtic Name: 1-(3-chlorophenyl)-3-[4-(phenylsulfonyl)piperazin-1-yl]pyrrole-2,5-dione Openeye Name: 3-[4-(benzenesulfonyl)piperazin-1-yl]-1-(3-chlorophenyl)pyrrole-2,5-dione CAS Name: 3-[4-(benzenesulfonyl)-1-piperazinyl]-1-(3-chlorophenyl)pyrrole-2,5-dione IUPAC Name: 3-[4-(benzenesulfonyl)piperazin-1-yl]-1-(3-chlorophenyl)pyrrole-2,5-dione Traditional Name: 3-(4-besylpiperazino)-1-(3-chlorophenyl)-3-pyrroline-2,5-quinone Formula: C20H18ClN3O4S MolecularWeight: 431.89262

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=O)N(C2=O)C3=CC(=CC=C3)Cl)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC(=O)N(C2=O)C3=CC(=CC=C3)Cl)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H18ClN3O4S/c21-15-5-4-6-16(13-15)24-19(25)14-18(20(24)26)22-9-11-23(12-10-22)29(27,28)17-7-2-1-3-8-17/h1-8,13-14H,9-12H2