2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-1-[4-(methylsulfanylmethyl)phenyl]ethanone

Systemtic Name: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-1-[4-(methylsulfanylmethyl)phenyl]ethanone Openeye Name: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-1-[4-(methylsulfanylmethyl)phenyl]ethanone CAS Name: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-1-[4-[(methylthio)methyl]phenyl]ethanone IUPAC Name: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-1-[4-(methylsulfanylmethyl)phenyl]ethanone Traditional Name: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-1-[4-[(methylthio)methyl]phenyl]ethanone Formula: C21H23NO3S MolecularWeight: 369.47722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN=C2CC(=O)C3=CC=C(C=C3)CSC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN=C2CC(=O)C3=CC=C(C=C3)CSC)OC

InChI

InChI=1S/C21H23NO3S/c1-24-20-10-16-8-9-22-18(17(16)11-21(20)25-2)12-19(23)15-6-4-14(5-7-15)13-26-3/h4-7,10-11H,8-9,12-13H2,1-3H3