2-[(2-chlorophenyl)methylsulfanyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propan-1-one

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propan-1-one Openeye Name: 2-[(2-chlorophenyl)methylsulfanyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propan-1-one CAS Name: 2-[(2-chlorophenyl)methylthio]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-1-propanone IUPAC Name: 2-[(2-chlorophenyl)methylsulfanyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropan-1-one Traditional Name: 2-[(2-chlorobenzyl)thio]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propan-1-one Formula: C20H22ClNOS MolecularWeight: 359.91278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N1CCC2=CC=CC=C2C1)SCC3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C(=O)N1CCC2=CC=CC=C2C1)SCC3=CC=CC=C3Cl

InChI

InChI=1S/C20H22ClNOS/c1-20(2,24-14-17-9-5-6-10-18(17)21)19(23)22-12-11-15-7-3-4-8-16(15)13-22/h3-10H,11-14H2,1-2H3