2-[4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)carbonylphenyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)carbonylphenyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(2-thienylsulfonyl)piperazine-1-carbonyl]phenyl]isoindoline-1,3-dione CAS Name: 2-[4-[oxo-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methyl]phenyl]isoindole-1,3-dione IUPAC Name: 2-[4-(4-thiophen-2-ylsulfonylpiperazine-1-carbonyl)phenyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(2-thienylsulfonyl)piperazine-1-carbonyl]phenyl]isoindoline-1,3-quinone Formula: C23H19N3O5S2 MolecularWeight: 481.54406

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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=CS5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C23H19N3O5S2/c27-21(24-11-13-25(14-12-24)33(30,31)20-6-3-15-32-20)16-7-9-17(10-8-16)26-22(28)18-4-1-2-5-19(18)23(26)29/h1-10,15H,11-14H2