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

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-ethyl-7-methyl-quinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(3-ethyl-7-methyl-2-quinolyl)sulfanyl]ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(3-ethyl-7-methyl-2-quinolinyl)thio]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-ethyl-7-methylquinolin-2-yl)sulfanylethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(3-ethyl-7-methyl-2-quinolyl)thio]ethanone Formula: C23H24N2OS MolecularWeight: 376.51446

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=C(C=CC2=C1)C)SCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCC1=C(N=C2C=C(C=CC2=C1)C)SCC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H24N2OS/c1-3-17-13-19-9-8-16(2)12-21(19)24-23(17)27-15-22(26)25-11-10-18-6-4-5-7-20(18)14-25/h4-9,12-13H,3,10-11,14-15H2,1-2H3