2-[(2,6-dimethylphenyl)amino]-N-isoquinolin-5-yl-2-[4-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[(2,6-dimethylphenyl)amino]-N-isoquinolin-5-yl-2-[4-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(2,6-dimethylanilino)-N-(5-isoquinolyl)-2-[4-(trifluoromethyl)phenyl]acetamide CAS Name: 2-(2,6-dimethylanilino)-N-(5-isoquinolinyl)-2-[4-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(2,6-dimethylanilino)-N-isoquinolin-5-yl-2-[4-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-(2,6-dimethylanilino)-N-(5-isoquinolyl)-2-[4-(trifluoromethyl)phenyl]acetamide Formula: C26H22F3N3O MolecularWeight: 449.46759

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(C2=CC=C(C=C2)C(F)(F)F)C(=O)NC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(C2=CC=C(C=C2)C(F)(F)F)C(=O)NC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C26H22F3N3O/c1-16-5-3-6-17(2)23(16)32-24(18-9-11-20(12-10-18)26(27,28)29)25(33)31-22-8-4-7-19-15-30-14-13-21(19)22/h3-15,24,32H,1-2H3,(H,31,33)