1-(4-methylpiperazin-4-ium-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanyl-ethanone Openeye Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanyl-ethanone CAS Name: 1-(4-methyl-1-piperazin-4-iumyl)-2-[(4-methyl-2-pyrimidinyl)thio]ethanone IUPAC Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-(4-methylpyrimidin-2-yl)sulfanylethanone Traditional Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-[(4-methylpyrimidin-2-yl)thio]ethanone Formula: C12H19N4OS+ MolecularWeight: 267.37046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC(=O)N2CC[NH+](CC2)C

Isomeric SMILES

CC1=NC(=NC=C1)SCC(=O)N2CC[NH+](CC2)C

InChI

InChI=1S/C12H18N4OS/c1-10-3-4-13-12(14-10)18-9-11(17)16-7-5-15(2)6-8-16/h3-4H,5-9H2,1-2H3/p+1