4-[6-(phenylsulfonyl)pyridin-3-yl]-4,9-diazabicyclo[4.2.1]nonane

Systemtic Name: 4-[6-(phenylsulfonyl)pyridin-3-yl]-4,9-diazabicyclo[4.2.1]nonane Openeye Name: 4-[6-(benzenesulfonyl)-3-pyridyl]-4,9-diazabicyclo[4.2.1]nonane CAS Name: 4-[6-(benzenesulfonyl)-3-pyridinyl]-4,9-diazabicyclo[4.2.1]nonane IUPAC Name: 4-[6-(benzenesulfonyl)pyridin-3-yl]-4,9-diazabicyclo[4.2.1]nonane Traditional Name: 4-(6-besyl-3-pyridyl)-4,9-diazabicyclo[4.2.1]nonane Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CN(CCC1N2)C3=CN=C(C=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC2CN(CCC1N2)C3=CN=C(C=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C18H21N3O2S/c22-24(23,17-4-2-1-3-5-17)18-9-8-16(12-19-18)21-11-10-14-6-7-15(13-21)20-14/h1-5,8-9,12,14-15,20H,6-7,10-11,13H2