N-tert-butyl-2-[4-[2-(4,8-dimethylquinolin-2-yl)sulfanylethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[2-(4,8-dimethylquinolin-2-yl)sulfanylethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[2-[(4,8-dimethyl-2-quinolyl)sulfanyl]acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[2-[(4,8-dimethyl-2-quinolinyl)thio]-1-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[2-(4,8-dimethylquinolin-2-yl)sulfanylacetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[2-[(4,8-dimethyl-2-quinolyl)thio]acetyl]piperazin-1-ium-1-yl]acetamide Formula: C23H33N4O2S+ MolecularWeight: 429.59872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)N3CC[NH+](CC3)CC(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)N3CC[NH+](CC3)CC(=O)NC(C)(C)C

InChI

InChI=1S/C23H32N4O2S/c1-16-7-6-8-18-17(2)13-20(24-22(16)18)30-15-21(29)27-11-9-26(10-12-27)14-19(28)25-23(3,4)5/h6-8,13H,9-12,14-15H2,1-5H3,(H,25,28)/p+1