2-[2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]ethyl]isoindoline-1,3-quinone Formula: C19H19N3O4S2 MolecularWeight: 417.50186

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C19H19N3O4S2/c23-18-15-5-1-2-6-16(15)19(24)22(18)11-12-27-17-8-7-14(13-20-17)28(25,26)21-9-3-4-10-21/h1-2,5-8,13H,3-4,9-12H2