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

Systemtic Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-[(2,6-dimethyl-4-pyrimidinyl)thio]ethanone IUPAC Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(2,6-dimethylpyrimidin-4-yl)sulfanylethanone Traditional Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-[(2,6-dimethylpyrimidin-4-yl)thio]ethanone Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)SCC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

CC1=CC(=NC(=N1)C)SCC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C19H23N3O3S/c1-12-7-18(21-13(2)20-12)26-11-19(23)22-6-5-14-8-16(24-3)17(25-4)9-15(14)10-22/h7-9H,5-6,10-11H2,1-4H3