N-(4-methylpiperazin-4-ium-1-yl)-2-(3-methylquinoxalin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-methylpiperazin-4-ium-1-yl)-2-(3-methylquinoxalin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-methylpiperazin-4-ium-1-yl)-2-(3-methylquinoxalin-2-yl)sulfanyl-acetamide CAS Name: N-(4-methyl-1-piperazin-4-iumyl)-2-[(3-methyl-2-quinoxalinyl)thio]acetamide IUPAC Name: N-(4-methylpiperazin-4-ium-1-yl)-2-(3-methylquinoxalin-2-yl)sulfanylacetamide Traditional Name: N-(4-methylpiperazin-4-ium-1-yl)-2-[(3-methylquinoxalin-2-yl)thio]acetamide Formula: C16H22N5OS+ MolecularWeight: 332.44378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1SCC(=O)NN3CC[NH+](CC3)C

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1SCC(=O)NN3CC[NH+](CC3)C

InChI

InChI=1S/C16H21N5OS/c1-12-16(18-14-6-4-3-5-13(14)17-12)23-11-15(22)19-21-9-7-20(2)8-10-21/h3-6H,7-11H2,1-2H3,(H,19,22)/p+1