2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-[[1-(4-bromophenyl)-2-imidazolyl]thio]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-[[1-(4-bromophenyl)imidazol-2-yl]thio]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C20H18BrN3OS MolecularWeight: 428.34542

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CSC3=NC=CN3C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CSC3=NC=CN3C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H18BrN3OS/c21-17-5-7-18(8-6-17)24-12-10-22-20(24)26-14-19(25)23-11-9-15-3-1-2-4-16(15)13-23/h1-8,10,12H,9,11,13-14H2