1-(4-bromophenyl)-3-[(5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]imidazole-2-thione

Systemtic Name: 1-(4-bromophenyl)-3-[(5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]imidazole-2-thione Openeye Name: 1-(4-bromophenyl)-3-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]imidazole-2-thione CAS Name: 1-(4-bromophenyl)-3-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-imidazolethione IUPAC Name: 1-(4-bromophenyl)-3-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]imidazole-2-thione Traditional Name: 1-(4-bromophenyl)-3-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4-imidazoline-2-thione Formula: C21H22BrN3O3S MolecularWeight: 476.38668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2CN(CC(C2=C(C=C1)OC)O)CN3C=CN(C3=S)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=C2CN(CC(C2=C(C=C1)OC)O)CN3C=CN(C3=S)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H22BrN3O3S/c1-27-18-7-8-19(28-2)20-16(18)11-23(12-17(20)26)13-24-9-10-25(21(24)29)15-5-3-14(22)4-6-15/h3-10,17,26H,11-13H2,1-2H3