1-(4-methylpiperidin-1-yl)-2-(3,6,7-trimethylquinolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-methylpiperidin-1-yl)-2-(3,6,7-trimethylquinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-(4-methyl-1-piperidyl)-2-[(3,6,7-trimethyl-2-quinolyl)sulfanyl]ethanone CAS Name: 1-(4-methyl-1-piperidinyl)-2-[(3,6,7-trimethyl-2-quinolinyl)thio]ethanone IUPAC Name: 1-(4-methylpiperidin-1-yl)-2-(3,6,7-trimethylquinolin-2-yl)sulfanylethanone Traditional Name: 1-(4-methylpiperidino)-2-[(3,6,7-trimethyl-2-quinolyl)thio]ethanone Formula: C20H26N2OS MolecularWeight: 342.49824

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSC2=NC3=CC(=C(C=C3C=C2C)C)C

Isomeric SMILES

CC1CCN(CC1)C(=O)CSC2=NC3=CC(=C(C=C3C=C2C)C)C

InChI

InChI=1S/C20H26N2OS/c1-13-5-7-22(8-6-13)19(23)12-24-20-16(4)10-17-9-14(2)15(3)11-18(17)21-20/h9-11,13H,5-8,12H2,1-4H3