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

Systemtic Name: 1-[(5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-3-(4-methoxyphenyl)imidazole-2-thione Openeye Name: 1-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-3-(4-methoxyphenyl)imidazole-2-thione CAS Name: 1-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-3-(4-methoxyphenyl)-2-imidazolethione IUPAC Name: 1-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-3-(4-methoxyphenyl)imidazole-2-thione Traditional Name: 1-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-3-(4-methoxyphenyl)-4-imidazoline-2-thione Formula: C22H25N3O4S MolecularWeight: 427.5166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=CN(C2=S)CN3CC(C4=C(C=CC(=C4C3)OC)OC)O

Isomeric SMILES

COC1=CC=C(C=C1)N2C=CN(C2=S)CN3CC(C4=C(C=CC(=C4C3)OC)OC)O

InChI

InChI=1S/C22H25N3O4S/c1-27-16-6-4-15(5-7-16)25-11-10-24(22(25)30)14-23-12-17-19(28-2)8-9-20(29-3)21(17)18(26)13-23/h4-11,18,26H,12-14H2,1-3H3