1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-[(3R,5R)-3,5-dimethyl-1-piperidyl]-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]ethanone CAS Name: 1-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-2-[(4,8-dimethyl-2-quinolinyl)thio]ethanone IUPAC Name: 1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-(4,8-dimethylquinolin-2-yl)sulfanylethanone Traditional Name: 1-[(3R,5R)-3,5-dimethylpiperidino]-2-[(4,8-dimethyl-2-quinolyl)thio]ethanone Formula: C20H26N2OS MolecularWeight: 342.49824

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CSC2=NC3=C(C=CC=C3C)C(=C2)C)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)C(=O)CSC2=NC3=C(C=CC=C3C)C(=C2)C)C

InChI

InChI=1S/C20H26N2OS/c1-13-8-14(2)11-22(10-13)19(23)12-24-18-9-16(4)17-7-5-6-15(3)20(17)21-18/h5-7,9,13-14H,8,10-12H2,1-4H3/t13-,14-/m1/s1