2-[6-butoxy-2-(3-chloranyl-4-methoxy-phenyl)-5-cyano-pyridin-3-yl]benzenesulfonamide

Systemtic Name: 2-[6-butoxy-2-(3-chloranyl-4-methoxy-phenyl)-5-cyano-pyridin-3-yl]benzenesulfonamide Openeye Name: 2-[6-butoxy-2-(3-chloro-4-methoxy-phenyl)-5-cyano-3-pyridyl]benzenesulfonamide CAS Name: 2-[6-butoxy-2-(3-chloro-4-methoxyphenyl)-5-cyano-3-pyridinyl]benzenesulfonamide IUPAC Name: 2-[6-butoxy-2-(3-chloro-4-methoxyphenyl)-5-cyanopyridin-3-yl]benzenesulfonamide Traditional Name: 2-[6-butoxy-2-(3-chloro-4-methoxy-phenyl)-5-cyano-3-pyridyl]benzenesulfonamide Formula: C23H22ClN3O4S MolecularWeight: 471.95648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC(=C(C=C1C#N)C2=CC=CC=C2S(=O)(=O)N)C3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CCCCOC1=NC(=C(C=C1C#N)C2=CC=CC=C2S(=O)(=O)N)C3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C23H22ClN3O4S/c1-3-4-11-31-23-16(14-25)12-18(17-7-5-6-8-21(17)32(26,28)29)22(27-23)15-9-10-20(30-2)19(24)13-15/h5-10,12-13H,3-4,11H2,1-2H3,(H2,26,28,29)