5-[4-(pyridin-3-ylmethoxy)naphthalen-2-yl]sulfonyl-2-thia-5-azabicyclo[2.2.1]heptane

Systemtic Name: 5-[4-(pyridin-3-ylmethoxy)naphthalen-2-yl]sulfonyl-2-thia-5-azabicyclo[2.2.1]heptane Openeye Name: 5-[[4-(3-pyridylmethoxy)-2-naphthyl]sulfonyl]-2-thia-5-azabicyclo[2.2.1]heptane CAS Name: 5-[[4-(3-pyridinylmethoxy)-2-naphthalenyl]sulfonyl]-2-thia-5-azabicyclo[2.2.1]heptane IUPAC Name: 5-[4-(pyridin-3-ylmethoxy)naphthalen-2-yl]sulfonyl-2-thia-5-azabicyclo[2.2.1]heptane Traditional Name: 5-[[4-(3-pyridylmethoxy)-2-naphthyl]sulfonyl]-2-thia-5-azabicyclo[2.2.1]heptane Formula: C21H20N2O3S2 MolecularWeight: 412.5251

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CN(C1CS2)S(=O)(=O)C3=CC4=CC=CC=C4C(=C3)OCC5=CN=CC=C5

Isomeric SMILES

C1C2CN(C1CS2)S(=O)(=O)C3=CC4=CC=CC=C4C(=C3)OCC5=CN=CC=C5

InChI

InChI=1S/C21H20N2O3S2/c24-28(25,23-12-18-9-17(23)14-27-18)19-8-16-5-1-2-6-20(16)21(10-19)26-13-15-4-3-7-22-11-15/h1-8,10-11,17-18H,9,12-14H2