N-(3-cyclopentylsulfonylphenyl)-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide

Systemtic Name: N-(3-cyclopentylsulfonylphenyl)-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(3-cyclopentylsulfonylphenyl)acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(3-cyclopentylsulfonylphenyl)acetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(3-cyclopentylsulfonylphenyl)acetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(3-cyclopentylsulfonylphenyl)acetamide Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=CC(=CC=C3)S(=O)(=O)C4CCCC4

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=CC(=CC=C3)S(=O)(=O)C4CCCC4

InChI

InChI=1S/C24H26N2O4S/c1-17(27)26-14-13-18-7-2-5-12-22(18)23(26)16-24(28)25-19-8-6-11-21(15-19)31(29,30)20-9-3-4-10-20/h2,5-8,11-15,20,23H,3-4,9-10,16H2,1H3,(H,25,28)