1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-(5-methylthiophen-2-yl)butane-1,4-dione

Systemtic Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-(5-methylthiophen-2-yl)butane-1,4-dione Openeye Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-(5-methyl-2-thienyl)butane-1,4-dione CAS Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-(5-methyl-2-thiophenyl)butane-1,4-dione IUPAC Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-(5-methylthiophen-2-yl)butane-1,4-dione Traditional Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-(5-methyl-2-thienyl)butane-1,4-dione Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C20H23NO4S/c1-13-4-6-19(26-13)16(22)5-7-20(23)21-9-8-14-10-17(24-2)18(25-3)11-15(14)12-21/h4,6,10-11H,5,7-9,12H2,1-3H3