2-[(4-fluorophenyl)-isoquinolin-5-ylsulfonyl-amino]-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-[(4-fluorophenyl)-isoquinolin-5-ylsulfonyl-amino]-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[4-fluoro-N-(5-isoquinolinylsulfonyl)anilino]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-(4-fluoro-N-isoquinolin-5-ylsulfonylanilino)-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: 2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]-N-mesityl-acetamide Formula: C26H24FN3O3S MolecularWeight: 477.550463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC4=C3C=CN=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC4=C3C=CN=C4)C

InChI

InChI=1S/C26H24FN3O3S/c1-17-13-18(2)26(19(3)14-17)29-25(31)16-30(22-9-7-21(27)8-10-22)34(32,33)24-6-4-5-20-15-28-12-11-23(20)24/h4-15H,16H2,1-3H3,(H,29,31)