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

Systemtic Name: 1-(7-chloranyl-8-sulfanyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 1-(7-chloro-8-sulfanyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 1-(7-chloro-8-mercapto-3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 1-(7-chloro-8-sulfanyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 1-(7-chloro-8-mercapto-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C11H12ClNOS MolecularWeight: 241.73708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12ClNOS/c1-7(14)13-5-4-8-2-3-10(12)11(15)9(8)6-13/h2-3,15H,4-6H2,1H3