1-(4-ethanoylpiperazin-1-yl)-2-(4-methylquinolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-ethanoylpiperazin-1-yl)-2-(4-methylquinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-[(4-methyl-2-quinolyl)sulfanyl]ethanone CAS Name: 1-(4-acetyl-1-piperazinyl)-2-[(4-methyl-2-quinolinyl)thio]ethanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-(4-methylquinolin-2-yl)sulfanylethanone Traditional Name: 1-(4-acetylpiperazino)-2-[(4-methyl-2-quinolyl)thio]ethanone Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C18H21N3O2S/c1-13-11-17(19-16-6-4-3-5-15(13)16)24-12-18(23)21-9-7-20(8-10-21)14(2)22/h3-6,11H,7-10,12H2,1-2H3