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

Systemtic Name: 2-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[(5-pyrrolidinosulfonyl-2-pyridyl)thio]methyl]isoindoline-1,3-quinone Formula: C18H17N3O4S2 MolecularWeight: 403.47528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C18H17N3O4S2/c22-17-14-5-1-2-6-15(14)18(23)21(17)12-26-16-8-7-13(11-19-16)27(24,25)20-9-3-4-10-20/h1-2,5-8,11H,3-4,9-10,12H2