N-[5-fluoranyl-2-(isoquinolin-1-ylamino)oxy-phenyl]-4-(2-sulfamoylphenyl)benzamide

Systemtic Name: N-[5-fluoranyl-2-(isoquinolin-1-ylamino)oxy-phenyl]-4-(2-sulfamoylphenyl)benzamide Openeye Name: N-[5-fluoro-2-(1-isoquinolylamino)oxy-phenyl]-4-(2-sulfamoylphenyl)benzamide CAS Name: N-[5-fluoro-2-(1-isoquinolinylamino)oxyphenyl]-4-(2-sulfamoylphenyl)benzamide IUPAC Name: N-[5-fluoro-2-(isoquinolin-1-ylamino)oxyphenyl]-4-(2-sulfamoylphenyl)benzamide Traditional Name: N-[5-fluoro-2-(1-isoquinolylamino)oxy-phenyl]-4-(2-sulfamoylphenyl)benzamide Formula: C28H21FN4O4S MolecularWeight: 528.554143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN=C2NOC3=C(C=C(C=C3)F)NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5S(=O)(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CN=C2NOC3=C(C=C(C=C3)F)NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5S(=O)(=O)N

InChI

InChI=1S/C28H21FN4O4S/c29-21-13-14-25(37-33-27-23-7-2-1-5-18(23)15-16-31-27)24(17-21)32-28(34)20-11-9-19(10-12-20)22-6-3-4-8-26(22)38(30,35)36/h1-17H,(H,31,33)(H,32,34)(H2,30,35,36)