1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-butan-1-one

Systemtic Name: 1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-butan-1-one Openeye Name: 1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-methyl-butan-1-one CAS Name: 1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-butanone IUPAC Name: 1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-methylbutan-1-one Traditional Name: 1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-methyl-butan-1-one Formula: C20H25NO3S MolecularWeight: 359.4824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC2=CC(=C(C=C2C1C3=CC=CS3)OC)OC

Isomeric SMILES

CC(C)CC(=O)N1CCC2=CC(=C(C=C2C1C3=CC=CS3)OC)OC

InChI

InChI=1S/C20H25NO3S/c1-13(2)10-19(22)21-8-7-14-11-16(23-3)17(24-4)12-15(14)20(21)18-6-5-9-25-18/h5-6,9,11-13,20H,7-8,10H2,1-4H3