2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C18H25N8O+ MolecularWeight: 369.4441

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)C3=NC=CC=N3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)C3=NC=CC=N3)C4=NC=CC=N4

InChI

InChI=1S/C18H24N8O/c27-16(24-11-13-26(14-12-24)18-21-5-2-6-22-18)15-23-7-9-25(10-8-23)17-19-3-1-4-20-17/h1-6H,7-15H2/p+1