4-oxidanylidene-4-(1-pyridin-4-yl-3,4-dihydro-1H-isoquinolin-2-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide

Systemtic Name: 4-oxidanylidene-4-(1-pyridin-4-yl-3,4-dihydro-1H-isoquinolin-2-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide Openeye Name: 4-oxo-4-[1-(4-pyridyl)-3,4-dihydro-1H-isoquinolin-2-yl]-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide CAS Name: 4-oxo-4-(1-pyridin-4-yl-3,4-dihydro-1H-isoquinolin-2-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide IUPAC Name: 4-oxo-4-(1-pyridin-4-yl-3,4-dihydro-1H-isoquinolin-2-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide Traditional Name: 4-keto-4-[1-(4-pyridyl)-3,4-dihydro-1H-isoquinolin-2-yl]-N-[3-(trifluoromethyl)benzyl]butyramide Formula: C26H24F3N3O2 MolecularWeight: 467.48287

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=CC=CC=C21)C3=CC=NC=C3)C(=O)CCC(=O)NCC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1CN(C(C2=CC=CC=C21)C3=CC=NC=C3)C(=O)CCC(=O)NCC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C26H24F3N3O2/c27-26(28,29)21-6-3-4-18(16-21)17-31-23(33)8-9-24(34)32-15-12-19-5-1-2-7-22(19)25(32)20-10-13-30-14-11-20/h1-7,10-11,13-14,16,25H,8-9,12,15,17H2,(H,31,33)