(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-quinolin-2-yl-methanone

Systemtic Name: (6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-quinolin-2-yl-methanone Openeye Name: [6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-(2-quinolyl)methanone CAS Name: (6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-(2-quinolinyl)methanone IUPAC Name: (6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-quinolin-2-ylmethanone Traditional Name: [6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-(2-quinolyl)methanone Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=NC4=CC=CC=C4C=C3)C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=NC4=CC=CC=C4C=C3)C5=CC=CS5)OC

InChI

InChI=1S/C25H22N2O3S/c1-29-21-14-17-11-12-27(24(23-8-5-13-31-23)18(17)15-22(21)30-2)25(28)20-10-9-16-6-3-4-7-19(16)26-20/h3-10,13-15,24H,11-12H2,1-2H3