3-ethyl-N-(4-methylpiperazin-4-ium-1-yl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine

Systemtic Name: 3-ethyl-N-(4-methylpiperazin-4-ium-1-yl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine Openeye Name: 3-ethyl-N-(4-methylpiperazin-4-ium-1-yl)triazolo[4,5-d]pyrimidin-7-amine CAS Name: 3-ethyl-N-(4-methyl-1-piperazin-4-iumyl)-7-triazolo[4,5-d]pyrimidinamine IUPAC Name: 3-ethyl-N-(4-methylpiperazin-4-ium-1-yl)triazolo[4,5-d]pyrimidin-7-amine Traditional Name: (3-ethyltriazolo[4,5-d]pyrimidin-7-yl)-(4-methylpiperazin-4-ium-1-yl)amine Formula: C11H19N8+ MolecularWeight: 263.32216

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=NC=N2)NN3CC[NH+](CC3)C)N=N1

Isomeric SMILES

CCN1C2=C(C(=NC=N2)NN3CC[NH+](CC3)C)N=N1

InChI

InChI=1S/C11H18N8/c1-3-19-11-9(14-16-19)10(12-8-13-11)15-18-6-4-17(2)5-7-18/h8H,3-7H2,1-2H3,(H,12,13,15)/p+1