1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]ethanone

Systemtic Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]ethanone Openeye Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-[4-(2-thienylmethyl)piperazine-1,4-diium-1-yl]ethanone CAS Name: 1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-[4-(thiophen-2-ylmethyl)-1-piperazine-1,4-diiumyl]ethanone IUPAC Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]ethanone Traditional Name: 1-[4-(2-pyrimidyl)piperazino]-2-[4-(2-thenyl)piperazine-1,4-diium-1-yl]ethanone Formula: C19H28N6OS+2 MolecularWeight: 388.53022

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=CS2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=CS2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C19H26N6OS/c26-18(24-10-12-25(13-11-24)19-20-4-2-5-21-19)16-23-8-6-22(7-9-23)15-17-3-1-14-27-17/h1-5,14H,6-13,15-16H2/p+2