1-[2-[6-(4-ethylsulfonylphenoxy)-2-pyridin-2-yl-3H-benzimidazol-5-yl]-4-fluoranyl-pyrrolidin-1-yl]ethanone

Systemtic Name: 1-[2-[6-(4-ethylsulfonylphenoxy)-2-pyridin-2-yl-3H-benzimidazol-5-yl]-4-fluoranyl-pyrrolidin-1-yl]ethanone Openeye Name: 1-[2-[6-(4-ethylsulfonylphenoxy)-2-(2-pyridyl)-3H-benzimidazol-5-yl]-4-fluoro-pyrrolidin-1-yl]ethanone CAS Name: 1-[2-[6-(4-ethylsulfonylphenoxy)-2-(2-pyridinyl)-3H-benzimidazol-5-yl]-4-fluoro-1-pyrrolidinyl]ethanone IUPAC Name: 1-[2-[6-(4-ethylsulfonylphenoxy)-2-pyridin-2-yl-3H-benzimidazol-5-yl]-4-fluoropyrrolidin-1-yl]ethanone Traditional Name: 1-[2-[6-(4-esylphenoxy)-2-(2-pyridyl)-3H-benzimidazol-5-yl]-4-fluoro-pyrrolidino]ethanone Formula: C26H25FN4O4S MolecularWeight: 508.564503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)OC2=CC3=C(C=C2C4CC(CN4C(=O)C)F)NC(=N3)C5=CC=CC=N5

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)OC2=CC3=C(C=C2C4CC(CN4C(=O)C)F)NC(=N3)C5=CC=CC=N5

InChI

InChI=1S/C26H25FN4O4S/c1-3-36(33,34)19-9-7-18(8-10-19)35-25-14-23-22(29-26(30-23)21-6-4-5-11-28-21)13-20(25)24-12-17(27)15-31(24)16(2)32/h4-11,13-14,17,24H,3,12,15H2,1-2H3,(H,29,30)