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

Systemtic Name: 2-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[4-(4-methoxyphenyl)-6-(trifluoromethyl)-2-pyrimidinyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3,4-dihydro-1H-isoquinoline Formula: C21H18F3N3O MolecularWeight: 385.38233

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=N2)N3CCC4=CC=CC=C4C3)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=N2)N3CCC4=CC=CC=C4C3)C(F)(F)F

InChI

InChI=1S/C21H18F3N3O/c1-28-17-8-6-15(7-9-17)18-12-19(21(22,23)24)26-20(25-18)27-11-10-14-4-2-3-5-16(14)13-27/h2-9,12H,10-11,13H2,1H3