N-[6-(4-fluoranylphenoxy)pyridin-3-yl]-1-(phenylsulfonyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[6-(4-fluoranylphenoxy)pyridin-3-yl]-1-(phenylsulfonyl)pyrrolidine-2-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[6-(4-fluorophenoxy)-3-pyridyl]pyrrolidine-2-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[6-(4-fluorophenoxy)-3-pyridinyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[6-(4-fluorophenoxy)pyridin-3-yl]pyrrolidine-2-carboxamide Traditional Name: 1-besyl-N-[6-(4-fluorophenoxy)-3-pyridyl]pyrrolidine-2-carboxamide Formula: C22H20FN3O4S MolecularWeight: 441.475303

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3=CN=C(C=C3)OC4=CC=C(C=C4)F

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3=CN=C(C=C3)OC4=CC=C(C=C4)F

InChI

InChI=1S/C22H20FN3O4S/c23-16-8-11-18(12-9-16)30-21-13-10-17(15-24-21)25-22(27)20-7-4-14-26(20)31(28,29)19-5-2-1-3-6-19/h1-3,5-6,8-13,15,20H,4,7,14H2,(H,25,27)