1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(2,3,5,6-tetramethylphenyl)sulfanyl-ethanone

Systemtic Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(2,3,5,6-tetramethylphenyl)sulfanyl-ethanone Openeye Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(2,3,5,6-tetramethylphenyl)sulfanyl-ethanone CAS Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-[(2,3,5,6-tetramethylphenyl)thio]ethanone IUPAC Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(2,3,5,6-tetramethylphenyl)sulfanylethanone Traditional Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-[(2,3,5,6-tetramethylphenyl)thio]ethanone Formula: C23H29NO3S MolecularWeight: 399.54626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)SCC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)SCC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)C)C

InChI

InChI=1S/C23H29NO3S/c1-14-9-15(2)17(4)23(16(14)3)28-13-22(25)24-8-7-18-10-20(26-5)21(27-6)11-19(18)12-24/h9-11H,7-8,12-13H2,1-6H3