3-(4-chlorophenyl)sulfanyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one Openeye Name: 3-(4-chlorophenyl)sulfanyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one CAS Name: 3-[(4-chlorophenyl)thio]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-propanone IUPAC Name: 3-(4-chlorophenyl)sulfanyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one Traditional Name: 3-[(4-chlorophenyl)thio]-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one Formula: C18H18ClNOS MolecularWeight: 331.85962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CCSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClNOS/c19-16-5-7-17(8-6-16)22-12-10-18(21)20-11-9-14-3-1-2-4-15(14)13-20/h1-8H,9-13H2