3,4-dihydro-1H-isoquinolin-2-yl-(6-fluoranyl-2-thiophen-2-yl-quinolin-4-yl)methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-(6-fluoranyl-2-thiophen-2-yl-quinolin-4-yl)methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[6-fluoro-2-(2-thienyl)-4-quinolyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-(6-fluoro-2-thiophen-2-yl-4-quinolinyl)methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-(6-fluoro-2-thiophen-2-ylquinolin-4-yl)methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[6-fluoro-2-(2-thienyl)-4-quinolyl]methanone Formula: C23H17FN2OS MolecularWeight: 388.457283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=NC4=C3C=C(C=C4)F)C5=CC=CS5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=NC4=C3C=C(C=C4)F)C5=CC=CS5

InChI

InChI=1S/C23H17FN2OS/c24-17-7-8-20-18(12-17)19(13-21(25-20)22-6-3-11-28-22)23(27)26-10-9-15-4-1-2-5-16(15)14-26/h1-8,11-13H,9-10,14H2