N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-yl-ethyl]-2-(4-fluorophenyl)ethanamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-yl-ethyl]-2-(4-fluorophenyl)ethanamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridyl)ethyl]-2-(4-fluorophenyl)acetamide CAS Name: N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridinyl)ethyl]-2-(4-fluorophenyl)acetamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-ylethyl]-2-(4-fluorophenyl)acetamide Traditional Name: N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridyl)ethyl]-2-(4-fluorophenyl)acetamide Formula: C22H19FN2O5S MolecularWeight: 442.460063

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)S(=O)(=O)C(CNC(=O)CC3=CC=C(C=C3)F)C4=CN=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)S(=O)(=O)C(CNC(=O)CC3=CC=C(C=C3)F)C4=CN=CC=C4

InChI

InChI=1S/C22H19FN2O5S/c23-17-5-3-15(4-6-17)10-22(26)25-13-21(16-2-1-9-24-12-16)31(27,28)18-7-8-19-20(11-18)30-14-29-19/h1-9,11-12,21H,10,13-14H2,(H,25,26)