2-methyl-5-[(3-methylpyridin-1-ium-1-yl)methyl]pyrimidin-4-amine

Systemtic Name: 2-methyl-5-[(3-methylpyridin-1-ium-1-yl)methyl]pyrimidin-4-amine Openeye Name: 2-methyl-5-[(3-methylpyridin-1-ium-1-yl)methyl]pyrimidin-4-amine CAS Name: 2-methyl-5-[(3-methyl-1-pyridin-1-iumyl)methyl]-4-pyrimidinamine IUPAC Name: 2-methyl-5-[(3-methylpyridin-1-ium-1-yl)methyl]pyrimidin-4-amine Traditional Name: [2-methyl-5-[(3-methylpyridin-1-ium-1-yl)methyl]pyrimidin-4-yl]amine Formula: C12H15N4+ MolecularWeight: 215.2743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)CC2=CN=C(N=C2N)C

Isomeric SMILES

CC1=C[N+](=CC=C1)CC2=CN=C(N=C2N)C

InChI

InChI=1S/C12H15N4/c1-9-4-3-5-16(7-9)8-11-6-14-10(2)15-12(11)13/h3-7H,8H2,1-2H3,(H2,13,14,15)/q+1