3-(5-pyridin-4-ylsulfonylpyridin-3-yl)-3,6-diazabicyclo[3.2.1]octane

Systemtic Name: 3-(5-pyridin-4-ylsulfonylpyridin-3-yl)-3,6-diazabicyclo[3.2.1]octane Openeye Name: 3-[5-(4-pyridylsulfonyl)-3-pyridyl]-3,6-diazabicyclo[3.2.1]octane CAS Name: 3-(5-pyridin-4-ylsulfonyl-3-pyridinyl)-3,6-diazabicyclo[3.2.1]octane IUPAC Name: 3-(5-pyridin-4-ylsulfonylpyridin-3-yl)-3,6-diazabicyclo[3.2.1]octane Traditional Name: 3-[5-(4-pyridylsulfonyl)-3-pyridyl]-3,6-diazabicyclo[3.2.1]octane Formula: C16H18N4O2S MolecularWeight: 330.40472

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CNC1CN(C2)C3=CC(=CN=C3)S(=O)(=O)C4=CC=NC=C4

Isomeric SMILES

C1C2CNC1CN(C2)C3=CC(=CN=C3)S(=O)(=O)C4=CC=NC=C4

InChI

InChI=1S/C16H18N4O2S/c21-23(22,15-1-3-17-4-2-15)16-6-14(8-18-9-16)20-10-12-5-13(11-20)19-7-12/h1-4,6,8-9,12-13,19H,5,7,10-11H2