1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-[(1-methyl-2-imidazolyl)thio]ethanone IUPAC Name: 1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylimidazol-2-yl)sulfanylethanone Traditional Name: 1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-[(1-methylimidazol-2-yl)thio]ethanone Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)N2CCC3=CC(=C(C=C3C2C4=CC=CC=C4)OC)OC

Isomeric SMILES

CN1C=CN=C1SCC(=O)N2CCC3=CC(=C(C=C3C2C4=CC=CC=C4)OC)OC

InChI

InChI=1S/C23H25N3O3S/c1-25-12-10-24-23(25)30-15-21(27)26-11-9-17-13-19(28-2)20(29-3)14-18(17)22(26)16-7-5-4-6-8-16/h4-8,10,12-14,22H,9,11,15H2,1-3H3