1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(7-methoxy-4-methyl-quinolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(7-methoxy-4-methyl-quinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(7-methoxy-4-methyl-2-quinolyl)sulfanyl]ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(7-methoxy-4-methyl-2-quinolinyl)thio]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(7-methoxy-4-methylquinolin-2-yl)sulfanylethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(7-methoxy-4-methyl-2-quinolyl)thio]ethanone Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC(=C2)OC)SCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC(=NC2=C1C=CC(=C2)OC)SCC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H22N2O2S/c1-15-11-21(23-20-12-18(26-2)7-8-19(15)20)27-14-22(25)24-10-9-16-5-3-4-6-17(16)13-24/h3-8,11-12H,9-10,13-14H2,1-2H3