N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-2-fluoranyl-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-2-fluoranyl-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: N-[1-[(3-cyanophenyl)methyl]-4-piperidyl]-2-fluoro-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: N-[1-[(3-cyanophenyl)methyl]-4-piperidinyl]-2-fluoro-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-2-fluoro-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: N-[1-(3-cyanobenzyl)-4-piperidyl]-2-fluoro-N-(3-pyridylmethyl)benzenesulfonamide Formula: C25H25FN4O2S MolecularWeight: 464.555003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N(CC2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3F)CC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCC1N(CC2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3F)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C25H25FN4O2S/c26-24-8-1-2-9-25(24)33(31,32)30(19-22-7-4-12-28-17-22)23-10-13-29(14-11-23)18-21-6-3-5-20(15-21)16-27/h1-9,12,15,17,23H,10-11,13-14,18-19H2