1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-(6-methoxy-3-methyl-quinolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-(6-methoxy-3-methyl-quinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-[(6-methoxy-3-methyl-2-quinolyl)sulfanyl]ethanone CAS Name: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-[(6-methoxy-3-methyl-2-quinolinyl)thio]ethanone IUPAC Name: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-(6-methoxy-3-methylquinolin-2-yl)sulfanylethanone Traditional Name: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-[(6-methoxy-3-methyl-2-quinolyl)thio]ethanone Formula: C27H24N2O2S MolecularWeight: 440.55666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1)OC)SCC(=O)N3C4=CC=CC=C4CCC5=CC=CC=C53

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1)OC)SCC(=O)N3C4=CC=CC=C4CCC5=CC=CC=C53

InChI

InChI=1S/C27H24N2O2S/c1-18-15-21-16-22(31-2)13-14-23(21)28-27(18)32-17-26(30)29-24-9-5-3-7-19(24)11-12-20-8-4-6-10-25(20)29/h3-10,13-16H,11-12,17H2,1-2H3