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

Systemtic Name: 2-[(4-fluorophenyl)-isoquinolin-5-ylsulfonyl-amino]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]acetamide CAS Name: 2-[4-fluoro-N-(5-isoquinolinylsulfonyl)anilino]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(4-fluoro-N-isoquinolin-5-ylsulfonylanilino)acetamide Traditional Name: N-benzyl-2-[4-fluoro-N-(5-isoquinolylsulfonyl)anilino]acetamide Formula: C24H20FN3O3S MolecularWeight: 449.497303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H20FN3O3S/c25-20-9-11-21(12-10-20)28(17-24(29)27-15-18-5-2-1-3-6-18)32(30,31)23-8-4-7-19-16-26-14-13-22(19)23/h1-14,16H,15,17H2,(H,27,29)