4-methyl-6-[4-(phenylmethyl)piperazin-4-ium-1-yl]pyrimidin-2-amine

Systemtic Name: 4-methyl-6-[4-(phenylmethyl)piperazin-4-ium-1-yl]pyrimidin-2-amine Openeye Name: 4-(4-benzylpiperazin-4-ium-1-yl)-6-methyl-pyrimidin-2-amine CAS Name: 4-methyl-6-[4-(phenylmethyl)-1-piperazin-4-iumyl]-2-pyrimidinamine IUPAC Name: 4-(4-benzylpiperazin-4-ium-1-yl)-6-methylpyrimidin-2-amine Traditional Name: [4-(4-benzylpiperazin-4-ium-1-yl)-6-methyl-pyrimidin-2-yl]amine Formula: C16H22N5+ MolecularWeight: 284.37938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NC(=N1)N)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C16H21N5/c1-13-11-15(19-16(17)18-13)21-9-7-20(8-10-21)12-14-5-3-2-4-6-14/h2-6,11H,7-10,12H2,1H3,(H2,17,18,19)/p+1