3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[5-[ethyl(phenyl)sulfamoyl]-2-[2,2,2-tris(fluoranyl)ethoxy]phenyl]benzamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[5-[ethyl(phenyl)sulfamoyl]-2-[2,2,2-tris(fluoranyl)ethoxy]phenyl]benzamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[5-[ethyl(phenyl)sulfamoyl]-2-(2,2,2-trifluoroethoxy)phenyl]benzamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[5-[ethyl(phenyl)sulfamoyl]-2-(2,2,2-trifluoroethoxy)phenyl]benzamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[5-[ethyl(phenyl)sulfamoyl]-2-(2,2,2-trifluoroethoxy)phenyl]benzamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[5-[ethyl(phenyl)sulfamoyl]-2-(2,2,2-trifluoroethoxy)phenyl]benzamide Formula: C32H30F3N3O6S2 MolecularWeight: 673.72231

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(F)(F)F)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(F)(F)F)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C32H30F3N3O6S2/c1-2-38(26-12-4-3-5-13-26)46(42,43)28-15-16-30(44-22-32(33,34)35)29(20-28)36-31(39)24-11-8-14-27(19-24)45(40,41)37-18-17-23-9-6-7-10-25(23)21-37/h3-16,19-20H,2,17-18,21-22H2,1H3,(H,36,39)