2,6-bis(1-phenylpiperazin-1-ium-1-yl)pyrimidin-4-amine

Systemtic Name: 2,6-bis(1-phenylpiperazin-1-ium-1-yl)pyrimidin-4-amine Openeye Name: 2,6-bis(1-phenylpiperazin-1-ium-1-yl)pyrimidin-4-amine CAS Name: 2,6-bis(1-phenyl-1-piperazin-1-iumyl)-4-pyrimidinamine IUPAC Name: 2,6-bis(1-phenylpiperazin-1-ium-1-yl)pyrimidin-4-amine Traditional Name: [2,6-bis(1-phenylpiperazin-1-ium-1-yl)pyrimidin-4-yl]amine Formula: C24H31N7+2 MolecularWeight: 417.54984

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1)(C2=CC=CC=C2)C3=NC(=NC(=C3)N)[N+]4(CCNCC4)C5=CC=CC=C5

Isomeric SMILES

C1C[N+](CCN1)(C2=CC=CC=C2)C3=NC(=NC(=C3)N)[N+]4(CCNCC4)C5=CC=CC=C5

InChI

InChI=1S/C24H31N7/c25-22-19-23(30(15-11-26-12-16-30)20-7-3-1-4-8-20)29-24(28-22)31(17-13-27-14-18-31)21-9-5-2-6-10-21/h1-10,19,26-27H,11-18H2,(H2,25,28,29)/q+2