2-[3-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-3-oxidanylidene-propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-3-oxidanylidene-propyl]isoindole-1,3-dione Openeye Name: 2-[3-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-3-oxo-propyl]isoindoline-1,3-dione CAS Name: 2-[3-[2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]-3-oxopropyl]isoindole-1,3-dione IUPAC Name: 2-[3-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-3-oxopropyl]isoindole-1,3-dione Traditional Name: 2-[3-keto-3-[2-(2-mesylbenzoyl)pyrazolidin-1-yl]propyl]isoindoline-1,3-quinone Formula: C22H21N3O6S MolecularWeight: 455.48364

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H21N3O6S/c1-32(30,31)18-10-5-4-9-17(18)22(29)25-13-6-12-24(25)19(26)11-14-23-20(27)15-7-2-3-8-16(15)21(23)28/h2-5,7-10H,6,11-14H2,1H3