1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,5,8-trimethylquinolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,5,8-trimethylquinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(3,5,8-trimethyl-2-quinolyl)sulfanyl]ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(3,5,8-trimethyl-2-quinolinyl)thio]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,5,8-trimethylquinolin-2-yl)sulfanylethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(3,5,8-trimethyl-2-quinolyl)thio]ethanone Formula: C23H24N2OS MolecularWeight: 376.51446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=NC2=C(C=C1)C)SCC(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CC1=C2C=C(C(=NC2=C(C=C1)C)SCC(=O)N3CCC4=CC=CC=C4C3)C

InChI

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