2-[isoquinolin-5-ylsulfonyl(propyl)amino]-N-[2-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[isoquinolin-5-ylsulfonyl(propyl)amino]-N-[2-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[5-isoquinolylsulfonyl(propyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[5-isoquinolinylsulfonyl(propyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[isoquinolin-5-ylsulfonyl(propyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[5-isoquinolylsulfonyl(propyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide Formula: C21H20F3N3O3S MolecularWeight: 451.46201

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC=CC=C1C(F)(F)F)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1C(F)(F)F)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C21H20F3N3O3S/c1-2-12-27(14-20(28)26-18-8-4-3-7-17(18)21(22,23)24)31(29,30)19-9-5-6-15-13-25-11-10-16(15)19/h3-11,13H,2,12,14H2,1H3,(H,26,28)