3,4-dihydro-1H-isoquinolin-2-yl-[5-[3-(trifluoromethyl)phenyl]thiophen-2-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-[3-(trifluoromethyl)phenyl]thiophen-2-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-[3-(trifluoromethyl)phenyl]-2-thienyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-[3-(trifluoromethyl)phenyl]-2-thiophenyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-[3-(trifluoromethyl)phenyl]thiophen-2-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-[3-(trifluoromethyl)phenyl]-2-thienyl]methanone Formula: C21H16F3NOS MolecularWeight: 387.41805

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=C(S3)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=C(S3)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H16F3NOS/c22-21(23,24)17-7-3-6-15(12-17)18-8-9-19(27-18)20(26)25-11-10-14-4-1-2-5-16(14)13-25/h1-9,12H,10-11,13H2