N-[[2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl]pyrimidin-2-amine

Systemtic Name: N-[[2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl]pyrimidin-2-amine Openeye Name: N-[[2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl]pyrimidin-2-amine CAS Name: N-[[2-[cyclohexyl(methyl)amino]-3-pyridin-1-iumyl]methyl]-2-pyrimidinamine IUPAC Name: N-[[2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl]pyrimidin-2-amine Traditional Name: cyclohexyl-methyl-[3-[(2-pyrimidylamino)methyl]pyridin-1-ium-2-yl]amine Formula: C17H24N5+ MolecularWeight: 298.40596

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C2=C(C=CC=[NH+]2)CNC3=NC=CC=N3

Isomeric SMILES

CN(C1CCCCC1)C2=C(C=CC=[NH+]2)CNC3=NC=CC=N3

InChI

InChI=1S/C17H23N5/c1-22(15-8-3-2-4-9-15)16-14(7-5-10-18-16)13-21-17-19-11-6-12-20-17/h5-7,10-12,15H,2-4,8-9,13H2,1H3,(H,19,20,21)/p+1