2-[(4-fluorophenyl)sulfonylamino]-N-isoquinolin-5-yl-benzamide

Systemtic Name: 2-[(4-fluorophenyl)sulfonylamino]-N-isoquinolin-5-yl-benzamide Openeye Name: 2-[(4-fluorophenyl)sulfonylamino]-N-(5-isoquinolyl)benzamide CAS Name: 2-[(4-fluorophenyl)sulfonylamino]-N-(5-isoquinolinyl)benzamide IUPAC Name: 2-[(4-fluorophenyl)sulfonylamino]-N-isoquinolin-5-ylbenzamide Traditional Name: 2-[(4-fluorophenyl)sulfonylamino]-N-(5-isoquinolyl)benzamide Formula: C22H16FN3O3S MolecularWeight: 421.444143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=CC3=C2C=CN=C3)NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=CC3=C2C=CN=C3)NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H16FN3O3S/c23-16-8-10-17(11-9-16)30(28,29)26-21-6-2-1-5-19(21)22(27)25-20-7-3-4-15-14-24-13-12-18(15)20/h1-14,26H,(H,25,27)