N-[5-cyano-2-(4-fluorophenyl)-6-(pyridin-4-ylmethylamino)pyridin-3-yl]benzenesulfonamide

Systemtic Name: N-[5-cyano-2-(4-fluorophenyl)-6-(pyridin-4-ylmethylamino)pyridin-3-yl]benzenesulfonamide Openeye Name: N-[5-cyano-2-(4-fluorophenyl)-6-(4-pyridylmethylamino)-3-pyridyl]benzenesulfonamide CAS Name: N-[5-cyano-2-(4-fluorophenyl)-6-(pyridin-4-ylmethylamino)-3-pyridinyl]benzenesulfonamide IUPAC Name: N-[5-cyano-2-(4-fluorophenyl)-6-(pyridin-4-ylmethylamino)pyridin-3-yl]benzenesulfonamide Traditional Name: N-[5-cyano-2-(4-fluorophenyl)-6-(4-pyridylmethylamino)-3-pyridyl]benzenesulfonamide Formula: C24H18FN5O2S MolecularWeight: 459.495423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=C(N=C(C(=C2)C#N)NCC3=CC=NC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=C(N=C(C(=C2)C#N)NCC3=CC=NC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H18FN5O2S/c25-20-8-6-18(7-9-20)23-22(30-33(31,32)21-4-2-1-3-5-21)14-19(15-26)24(29-23)28-16-17-10-12-27-13-11-17/h1-14,30H,16H2,(H,28,29)