N-[(2-ethoxypyridin-3-yl)methyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(2-ethoxypyridin-3-yl)methyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[(2-ethoxy-3-pyridyl)methyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[(2-ethoxy-3-pyridinyl)methyl]-1-(4-fluorophenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-[(2-ethoxypyridin-3-yl)methyl]-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[(2-ethoxy-3-pyridyl)methyl]-1-(4-fluorophenyl)sulfonyl-nipecotamide Formula: C20H24FN3O4S MolecularWeight: 421.485663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=C(C=CC=N1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H24FN3O4S/c1-2-28-20-15(5-3-11-22-20)13-23-19(25)16-6-4-12-24(14-16)29(26,27)18-9-7-17(21)8-10-18/h3,5,7-11,16H,2,4,6,12-14H2,1H3,(H,23,25)