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

Systemtic Name: N-[5-cyano-6-(cyclohexylmethylamino)-2-(4-fluorophenyl)pyridin-3-yl]benzenesulfonamide Openeye Name: N-[5-cyano-6-(cyclohexylmethylamino)-2-(4-fluorophenyl)-3-pyridyl]benzenesulfonamide CAS Name: N-[5-cyano-6-(cyclohexylmethylamino)-2-(4-fluorophenyl)-3-pyridinyl]benzenesulfonamide IUPAC Name: N-[5-cyano-6-(cyclohexylmethylamino)-2-(4-fluorophenyl)pyridin-3-yl]benzenesulfonamide Traditional Name: N-[5-cyano-6-(cyclohexylmethylamino)-2-(4-fluorophenyl)-3-pyridyl]benzenesulfonamide Formula: C25H25FN4O2S MolecularWeight: 464.555003

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC2=NC(=C(C=C2C#N)NS(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCC(CC1)CNC2=NC(=C(C=C2C#N)NS(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H25FN4O2S/c26-21-13-11-19(12-14-21)24-23(30-33(31,32)22-9-5-2-6-10-22)15-20(16-27)25(29-24)28-17-18-7-3-1-4-8-18/h2,5-6,9-15,18,30H,1,3-4,7-8,17H2,(H,28,29)