2-[(4-fluorophenyl)-isoquinolin-5-ylsulfonyl-amino]-N-naphthalen-1-yl-ethanamide

Systemtic Name: 2-[(4-fluorophenyl)-isoquinolin-5-ylsulfonyl-amino]-N-naphthalen-1-yl-ethanamide Openeye Name: 2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]-N-(1-naphthyl)acetamide CAS Name: 2-[4-fluoro-N-(5-isoquinolinylsulfonyl)anilino]-N-(1-naphthalenyl)acetamide IUPAC Name: 2-(4-fluoro-N-isoquinolin-5-ylsulfonylanilino)-N-naphthalen-1-ylacetamide Traditional Name: 2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]-N-(1-naphthyl)acetamide Formula: C27H20FN3O3S MolecularWeight: 485.529403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=O)CN(C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC5=C4C=CN=C5

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=O)CN(C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C27H20FN3O3S/c28-21-11-13-22(14-12-21)31(35(33,34)26-10-4-7-20-17-29-16-15-24(20)26)18-27(32)30-25-9-3-6-19-5-1-2-8-23(19)25/h1-17H,18H2,(H,30,32)