N-(4-methylpiperazin-4-ium-1-yl)-2-quinolin-8-ylsulfanyl-ethanamide

Systemtic Name: N-(4-methylpiperazin-4-ium-1-yl)-2-quinolin-8-ylsulfanyl-ethanamide Openeye Name: N-(4-methylpiperazin-4-ium-1-yl)-2-(8-quinolylsulfanyl)acetamide CAS Name: N-(4-methyl-1-piperazin-4-iumyl)-2-(8-quinolinylthio)acetamide IUPAC Name: N-(4-methylpiperazin-4-ium-1-yl)-2-quinolin-8-ylsulfanylacetamide Traditional Name: N-(4-methylpiperazin-4-ium-1-yl)-2-(8-quinolylthio)acetamide Formula: C16H21N4OS+ MolecularWeight: 317.42914

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)CSC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)CSC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C16H20N4OS/c1-19-8-10-20(11-9-19)18-15(21)12-22-14-6-2-4-13-5-3-7-17-16(13)14/h2-7H,8-12H2,1H3,(H,18,21)/p+1