1-(4-methylpiperazin-4-ium-1-yl)-2-quinoxalin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-quinoxalin-2-ylsulfanyl-ethanone Openeye Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-quinoxalin-2-ylsulfanyl-ethanone CAS Name: 1-(4-methyl-1-piperazin-4-iumyl)-2-(2-quinoxalinylthio)ethanone IUPAC Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-quinoxalin-2-ylsulfanylethanone Traditional Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-(quinoxalin-2-ylthio)ethanone Formula: C15H19N4OS+ MolecularWeight: 303.40256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3N=C2

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3N=C2

InChI

InChI=1S/C15H18N4OS/c1-18-6-8-19(9-7-18)15(20)11-21-14-10-16-12-4-2-3-5-13(12)17-14/h2-5,10H,6-9,11H2,1H3/p+1