2,4-bis(fluoranyl)-5-(2-isoquinolin-4-ylethyl)-N-(3-methyl-4-propan-2-yl-phenyl)benzamide

Systemtic Name: 2,4-bis(fluoranyl)-5-(2-isoquinolin-4-ylethyl)-N-(3-methyl-4-propan-2-yl-phenyl)benzamide Openeye Name: 2,4-difluoro-N-(4-isopropyl-3-methyl-phenyl)-5-[2-(4-isoquinolyl)ethyl]benzamide CAS Name: 2,4-difluoro-5-[2-(4-isoquinolinyl)ethyl]-N-(3-methyl-4-propan-2-ylphenyl)benzamide IUPAC Name: 2,4-difluoro-5-(2-isoquinolin-4-ylethyl)-N-(3-methyl-4-propan-2-ylphenyl)benzamide Traditional Name: 2,4-difluoro-N-(4-isopropyl-3-methyl-phenyl)-5-[2-(4-isoquinolyl)ethyl]benzamide Formula: C28H26F2N2O MolecularWeight: 444.515646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2F)F)CCC3=CN=CC4=CC=CC=C43)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2F)F)CCC3=CN=CC4=CC=CC=C43)C(C)C

InChI

InChI=1S/C28H26F2N2O/c1-17(2)23-11-10-22(12-18(23)3)32-28(33)25-13-19(26(29)14-27(25)30)8-9-21-16-31-15-20-6-4-5-7-24(20)21/h4-7,10-17H,8-9H2,1-3H3,(H,32,33)