3,4-dihydro-1H-isoquinolin-2-yl-[1-thiophen-2-ylcarbonyl-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-thiophen-2-ylcarbonyl-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(thiophene-2-carbonyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-[oxo(thiophen-2-yl)methyl]-4-[3-(trifluoromethyl)phenyl]-3-pyrrolidinyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(thiophene-2-carbonyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(2-thenoyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl]methanone Formula: C26H23F3N2O2S MolecularWeight: 484.53323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3CN(CC3C4=CC(=CC=C4)C(F)(F)F)C(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3CN(CC3C4=CC(=CC=C4)C(F)(F)F)C(=O)C5=CC=CS5

InChI

InChI=1S/C26H23F3N2O2S/c27-26(28,29)20-8-3-7-18(13-20)21-15-31(25(33)23-9-4-12-34-23)16-22(21)24(32)30-11-10-17-5-1-2-6-19(17)14-30/h1-9,12-13,21-22H,10-11,14-16H2