2-[2-methyl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[2-methyl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[2-methyl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[2-methyl-6-[3-(trifluoromethyl)phenyl]-4-pyrimidinyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[2-methyl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[2-methyl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline Formula: C21H18F3N3 MolecularWeight: 369.38293

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCC3=CC=CC=C3C2)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCC3=CC=CC=C3C2)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H18F3N3/c1-14-25-19(16-7-4-8-18(11-16)21(22,23)24)12-20(26-14)27-10-9-15-5-2-3-6-17(15)13-27/h2-8,11-12H,9-10,13H2,1H3