1-(7-chloranyl-8-methylsulfanyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 1-(7-chloranyl-8-methylsulfanyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 1-(7-chloro-8-methylsulfanyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 1-[7-chloro-8-(methylthio)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone IUPAC Name: 1-(7-chloro-8-methylsulfanyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 1-[7-chloro-8-(methylthio)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Formula: C12H14ClNOS MolecularWeight: 255.76366

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C(C1)C(=C(C=C2)Cl)SC

Isomeric SMILES

CC(=O)N1CCC2=C(C1)C(=C(C=C2)Cl)SC

InChI

InChI=1S/C12H14ClNOS/c1-8(15)14-6-5-9-3-4-11(13)12(16-2)10(9)7-14/h3-4H,5-7H2,1-2H3