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

Systemtic Name: 1-[(5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-3-methyl-benzimidazole-2-thione Openeye Name: 1-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-3-methyl-benzimidazole-2-thione CAS Name: 1-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-3-methyl-2-benzimidazolethione IUPAC Name: 1-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-3-methylbenzimidazole-2-thione Traditional Name: 1-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-3-methyl-benzimidazole-2-thione Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=S)CN3CC(C4=C(C=CC(=C4C3)OC)OC)O

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=S)CN3CC(C4=C(C=CC(=C4C3)OC)OC)O

InChI

InChI=1S/C20H23N3O3S/c1-21-14-6-4-5-7-15(14)23(20(21)27)12-22-10-13-17(25-2)8-9-18(26-3)19(13)16(24)11-22/h4-9,16,24H,10-12H2,1-3H3