2-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-1-ium-3-amine

Systemtic Name: 2-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-1-ium-3-amine Openeye Name: 2-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-1-ium-3-amine CAS Name: 2-[4-(2-pyrimidinyl)-1-piperazinyl]-3-pyridin-1-iumamine IUPAC Name: 2-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-1-ium-3-amine Traditional Name: [2-[4-(2-pyrimidyl)piperazino]pyridin-1-ium-3-yl]amine Formula: C13H17N6+ MolecularWeight: 257.31428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=[NH+]2)N)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=[NH+]2)N)C3=NC=CC=N3

InChI

InChI=1S/C13H16N6/c14-11-3-1-4-15-12(11)18-7-9-19(10-8-18)13-16-5-2-6-17-13/h1-6H,7-10,14H2/p+1