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

Systemtic Name: 2-[(4-fluorophenyl)-isoquinolin-5-ylsulfonyl-amino]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]-N-(3-nitrophenyl)acetamide CAS Name: 2-[4-fluoro-N-(5-isoquinolinylsulfonyl)anilino]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-(4-fluoro-N-isoquinolin-5-ylsulfonylanilino)-N-(3-nitrophenyl)acetamide Traditional Name: 2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]-N-(3-nitrophenyl)acetamide Formula: C23H17FN4O5S MolecularWeight: 480.468283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C23H17FN4O5S/c24-17-7-9-19(10-8-17)27(15-23(29)26-18-4-2-5-20(13-18)28(30)31)34(32,33)22-6-1-3-16-14-25-12-11-21(16)22/h1-14H,15H2,(H,26,29)