2-[(4-fluorophenyl)-isoquinolin-5-ylsulfonyl-amino]-N-(3-methoxyphenyl)ethanamide

Systemtic Name: 2-[(4-fluorophenyl)-isoquinolin-5-ylsulfonyl-amino]-N-(3-methoxyphenyl)ethanamide Openeye Name: 2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]-N-(3-methoxyphenyl)acetamide CAS Name: 2-[4-fluoro-N-(5-isoquinolinylsulfonyl)anilino]-N-(3-methoxyphenyl)acetamide IUPAC Name: 2-(4-fluoro-N-isoquinolin-5-ylsulfonylanilino)-N-(3-methoxyphenyl)acetamide Traditional Name: 2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]-N-(3-methoxyphenyl)acetamide Formula: C24H20FN3O4S MolecularWeight: 465.496703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C24H20FN3O4S/c1-32-21-6-3-5-19(14-21)27-24(29)16-28(20-10-8-18(25)9-11-20)33(30,31)23-7-2-4-17-15-26-13-12-22(17)23/h2-15H,16H2,1H3,(H,27,29)