[1-azanyl-4-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)butylidene]azanium

Systemtic Name: [1-azanyl-4-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)butylidene]azanium Openeye Name: [1-amino-4-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)butylidene]ammonium CAS Name: [1-amino-4-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]butylidene]ammonium IUPAC Name: [1-amino-4-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)butylidene]azanium Traditional Name: [1-amino-4-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]butylidene]ammonium Formula: C12H22N6+2 MolecularWeight: 250.34328

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCC(=[NH2+])N)C2=NC=CC=N2

Isomeric SMILES

C1CN(CC[NH+]1CCCC(=[NH2+])N)C2=NC=CC=N2

InChI

InChI=1S/C12H20N6/c13-11(14)3-1-6-17-7-9-18(10-8-17)12-15-4-2-5-16-12/h2,4-5H,1,3,6-10H2,(H3,13,14)/p+2