(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-[6-(trifluoromethyl)pyridin-3-yl]methanone

Systemtic Name: (6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-[6-(trifluoromethyl)pyridin-3-yl]methanone Openeye Name: [6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-[6-(trifluoromethyl)-3-pyridyl]methanone CAS Name: (6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanone IUPAC Name: (6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-[6-(trifluoromethyl)pyridin-3-yl]methanone Traditional Name: [6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-[6-(trifluoromethyl)-3-pyridyl]methanone Formula: C22H19F3N2O3S MolecularWeight: 448.45807

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CN=C(C=C3)C(F)(F)F)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CN=C(C=C3)C(F)(F)F)C4=CC=CS4)OC

InChI

InChI=1S/C22H19F3N2O3S/c1-29-16-10-13-7-8-27(21(28)14-5-6-19(26-12-14)22(23,24)25)20(18-4-3-9-31-18)15(13)11-17(16)30-2/h3-6,9-12,20H,7-8H2,1-2H3