1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5,8-dimethoxy-4-methyl-quinolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5,8-dimethoxy-4-methyl-quinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(5,8-dimethoxy-4-methyl-2-quinolyl)sulfanyl]ethanone CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(5,8-dimethoxy-4-methyl-2-quinolinyl)thio]ethanone IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5,8-dimethoxy-4-methylquinolin-2-yl)sulfanylethanone Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(5,8-dimethoxy-4-methyl-2-quinolyl)thio]ethanone Formula: C22H21NO5S MolecularWeight: 411.47084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C(C=CC(=C12)OC)OC)SCC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC(=NC2=C(C=CC(=C12)OC)OC)SCC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H21NO5S/c1-13-10-20(23-22-18(26-3)7-6-17(25-2)21(13)22)29-12-15(24)14-4-5-16-19(11-14)28-9-8-27-16/h4-7,10-11H,8-9,12H2,1-3H3