2-[(4-fluorophenyl)-isoquinolin-5-ylsulfonyl-amino]-N,N-di(propan-2-yl)ethanamide

Systemtic Name: 2-[(4-fluorophenyl)-isoquinolin-5-ylsulfonyl-amino]-N,N-di(propan-2-yl)ethanamide Openeye Name: 2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]-N,N-diisopropyl-acetamide CAS Name: 2-[4-fluoro-N-(5-isoquinolinylsulfonyl)anilino]-N,N-di(propan-2-yl)acetamide IUPAC Name: 2-(4-fluoro-N-isoquinolin-5-ylsulfonylanilino)-N,N-di(propan-2-yl)acetamide Traditional Name: 2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]-N,N-diisopropyl-acetamide Formula: C23H26FN3O3S MolecularWeight: 443.534243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)C(=O)CN(C1=CC=C(C=C1)F)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CC(C)N(C(C)C)C(=O)CN(C1=CC=C(C=C1)F)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C23H26FN3O3S/c1-16(2)27(17(3)4)23(28)15-26(20-10-8-19(24)9-11-20)31(29,30)22-7-5-6-18-14-25-13-12-21(18)22/h5-14,16-17H,15H2,1-4H3