8-(methylsulfonylmethylsulfonyl)-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-3-carbonitrile

Systemtic Name: 8-(methylsulfonylmethylsulfonyl)-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-3-carbonitrile Openeye Name: 8-(methylsulfonylmethylsulfonyl)-3-(3-pyridyl)-8-azabicyclo[3.2.1]octane-3-carbonitrile CAS Name: 8-(methylsulfonylmethylsulfonyl)-3-(3-pyridinyl)-8-azabicyclo[3.2.1]octane-3-carbonitrile IUPAC Name: 8-(methylsulfonylmethylsulfonyl)-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-3-carbonitrile Traditional Name: 8-(mesylmethylsulfonyl)-3-(3-pyridyl)-8-azabicyclo[3.2.1]octane-3-carbonitrile Formula: C15H19N3O4S2 MolecularWeight: 369.45906

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CS(=O)(=O)N1C2CCC1CC(C2)(C#N)C3=CN=CC=C3

Isomeric SMILES

CS(=O)(=O)CS(=O)(=O)N1C2CCC1CC(C2)(C#N)C3=CN=CC=C3

InChI

InChI=1S/C15H19N3O4S2/c1-23(19,20)11-24(21,22)18-13-4-5-14(18)8-15(7-13,10-16)12-3-2-6-17-9-12/h2-3,6,9,13-14H,4-5,7-8,11H2,1H3