2-(3,4-dihydroisoquinolin-1-ylsulfanyl)-1-(4-phenylphenyl)ethanone bromide

Systemtic Name: 2-(3,4-dihydroisoquinolin-1-ylsulfanyl)-1-(4-phenylphenyl)ethanone bromide Openeye Name: 2-(3,4-dihydroisoquinolin-1-ylsulfanyl)-1-(4-phenylphenyl)ethanone bromide CAS Name: 2-(3,4-dihydroisoquinolin-1-ylthio)-1-(4-phenylphenyl)ethanone bromide IUPAC Name: 2-(3,4-dihydroisoquinolin-1-ylsulfanyl)-1-(4-phenylphenyl)ethanone bromide Traditional Name: 2-(3,4-dihydroisoquinolin-1-ylthio)-1-(4-phenylphenyl)ethanone bromide Formula: C23H19BrNOS- MolecularWeight: 437.37206

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C2=CC=CC=C21)SCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

C1CN=C(C2=CC=CC=C21)SCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C23H19NOS.BrH/c25-22(16-26-23-21-9-5-4-8-19(21)14-15-24-23)20-12-10-18(11-13-20)17-6-2-1-3-7-17;/h1-13H,14-16H2;1H/p-1