2-(3-methyl-3H-isoquinolin-2-yl)-1-(4-methylsulfanylphenyl)ethanone

Systemtic Name: 2-(3-methyl-3H-isoquinolin-2-yl)-1-(4-methylsulfanylphenyl)ethanone Openeye Name: 2-(3-methyl-3H-isoquinolin-2-yl)-1-(4-methylsulfanylphenyl)ethanone CAS Name: 2-(3-methyl-3H-isoquinolin-2-yl)-1-[4-(methylthio)phenyl]ethanone IUPAC Name: 2-(3-methyl-3H-isoquinolin-2-yl)-1-(4-methylsulfanylphenyl)ethanone Traditional Name: 2-(3-methyl-3H-isoquinolin-2-yl)-1-[4-(methylthio)phenyl]ethanone Formula: C19H19NOS MolecularWeight: 309.42526

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C2C=CC=CC2=CN1CC(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC1C=C2C=CC=CC2=CN1CC(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C19H19NOS/c1-14-11-16-5-3-4-6-17(16)12-20(14)13-19(21)15-7-9-18(22-2)10-8-15/h3-12,14H,13H2,1-2H3