N-(4-isoquinolin-5-ylphenyl)-3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)benzamide

Systemtic Name: N-(4-isoquinolin-5-ylphenyl)-3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)benzamide Openeye Name: N-[4-(5-isoquinolyl)phenyl]-3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)benzamide CAS Name: N-[4-(5-isoquinolinyl)phenyl]-3-(4-methyl-1-imidazolyl)-5-(trifluoromethyl)benzamide IUPAC Name: N-(4-isoquinolin-5-ylphenyl)-3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)benzamide Traditional Name: N-[4-(5-isoquinolyl)phenyl]-3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)benzamide Formula: C27H19F3N4O MolecularWeight: 472.46117

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C=N1)C2=CC(=CC(=C2)C(F)(F)F)C(=O)NC3=CC=C(C=C3)C4=CC=CC5=C4C=CN=C5

Isomeric SMILES

CC1=CN(C=N1)C2=CC(=CC(=C2)C(F)(F)F)C(=O)NC3=CC=C(C=C3)C4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C27H19F3N4O/c1-17-15-34(16-32-17)23-12-20(11-21(13-23)27(28,29)30)26(35)33-22-7-5-18(6-8-22)24-4-2-3-19-14-31-10-9-25(19)24/h2-16H,1H3,(H,33,35)