5-fluoranyl-N-isoquinolin-5-yl-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxamide

Systemtic Name: 5-fluoranyl-N-isoquinolin-5-yl-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxamide Openeye Name: 5-fluoro-N-(5-isoquinolyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxamide CAS Name: 5-fluoro-N-(5-isoquinolinyl)-1-[[3-(trifluoromethyl)phenyl]methyl]-2-indolecarboxamide IUPAC Name: 5-fluoro-N-isoquinolin-5-yl-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxamide Traditional Name: 5-fluoro-N-(5-isoquinolyl)-1-[3-(trifluoromethyl)benzyl]indole-2-carboxamide Formula: C26H17F4N3O MolecularWeight: 463.426293

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CN2C3=C(C=C(C=C3)F)C=C2C(=O)NC4=CC=CC5=C4C=CN=C5

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CN2C3=C(C=C(C=C3)F)C=C2C(=O)NC4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C26H17F4N3O/c27-20-7-8-23-18(12-20)13-24(33(23)15-16-3-1-5-19(11-16)26(28,29)30)25(34)32-22-6-2-4-17-14-31-10-9-21(17)22/h1-14H,15H2,(H,32,34)