2-(4-pyrimidin-2-ylpiperazine-1,4-diium-1-yl)quinazolin-4-amine

Systemtic Name: 2-(4-pyrimidin-2-ylpiperazine-1,4-diium-1-yl)quinazolin-4-amine Openeye Name: 2-(4-pyrimidin-2-ylpiperazine-1,4-diium-1-yl)quinazolin-4-amine CAS Name: 2-[4-(2-pyrimidinyl)-1-piperazine-1,4-diiumyl]-4-quinazolinamine IUPAC Name: 2-(4-pyrimidin-2-ylpiperazine-1,4-diium-1-yl)quinazolin-4-amine Traditional Name: [2-[4-(2-pyrimidyl)piperazine-1,4-diium-1-yl]quinazolin-4-yl]amine Formula: C16H19N7+2 MolecularWeight: 309.36896

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1C2=NC=CC=N2)C3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

C1C[NH+](CC[NH+]1C2=NC=CC=N2)C3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C16H17N7/c17-14-12-4-1-2-5-13(12)20-16(21-14)23-10-8-22(9-11-23)15-18-6-3-7-19-15/h1-7H,8-11H2,(H2,17,20,21)/p+2