1-[4-(3-methoxyphenyl)piperazin-1-yl]-2-(4-methylquinolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[4-(3-methoxyphenyl)piperazin-1-yl]-2-(4-methylquinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-[4-(3-methoxyphenyl)piperazin-1-yl]-2-[(4-methyl-2-quinolyl)sulfanyl]ethanone CAS Name: 1-[4-(3-methoxyphenyl)-1-piperazinyl]-2-[(4-methyl-2-quinolinyl)thio]ethanone IUPAC Name: 1-[4-(3-methoxyphenyl)piperazin-1-yl]-2-(4-methylquinolin-2-yl)sulfanylethanone Traditional Name: 1-[4-(3-methoxyphenyl)piperazino]-2-[(4-methyl-2-quinolyl)thio]ethanone Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)N3CCN(CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)N3CCN(CC3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C23H25N3O2S/c1-17-14-22(24-21-9-4-3-8-20(17)21)29-16-23(27)26-12-10-25(11-13-26)18-6-5-7-19(15-18)28-2/h3-9,14-15H,10-13,16H2,1-2H3