6-methyl-N4-[(1S)-1-(1-methylpyrazol-4-yl)propyl]pyrimidin-3-ium-2,4-diamine

Systemtic Name: 6-methyl-N4-[(1S)-1-(1-methylpyrazol-4-yl)propyl]pyrimidin-3-ium-2,4-diamine Openeye Name: 6-methyl-N4-[(1S)-1-(1-methylpyrazol-4-yl)propyl]pyrimidin-3-ium-2,4-diamine CAS Name: 6-methyl-N4-[(1S)-1-(1-methyl-4-pyrazolyl)propyl]pyrimidin-3-ium-2,4-diamine IUPAC Name: 6-methyl-4-N-[(1S)-1-(1-methylpyrazol-4-yl)propyl]pyrimidin-3-ium-2,4-diamine Traditional Name: (2-amino-6-methyl-pyrimidin-3-ium-4-yl)-[(1S)-1-(1-methylpyrazol-4-yl)propyl]amine Formula: C12H19N6+ MolecularWeight: 247.31946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CN(N=C1)C)NC2=[NH+]C(=NC(=C2)C)N

Isomeric SMILES

CC[C@@H](C1=CN(N=C1)C)NC2=[NH+]C(=NC(=C2)C)N

InChI

InChI=1S/C12H18N6/c1-4-10(9-6-14-18(3)7-9)16-11-5-8(2)15-12(13)17-11/h5-7,10H,4H2,1-3H3,(H3,13,15,16,17)/p+1/t10-/m0/s1