[(2R)-2-(1-methylpyrazol-4-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]azanium

Systemtic Name: [(2R)-2-(1-methylpyrazol-4-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]azanium Openeye Name: [(2R)-2-(1-methylpyrazol-4-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]ammonium CAS Name: [(2R)-2-(1-methyl-4-pyrazolyl)-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]ammonium IUPAC Name: [(2R)-2-(1-methylpyrazol-4-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]azanium Traditional Name: [(2R)-2-(1-methylpyrazol-4-yl)-2-[4-(2-pyrimidyl)piperazino]ethyl]ammonium Formula: C14H22N7+ MolecularWeight: 288.37138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(C[NH3+])N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CN1C=C(C=N1)[C@H](C[NH3+])N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C14H21N7/c1-19-11-12(10-18-19)13(9-15)20-5-7-21(8-6-20)14-16-3-2-4-17-14/h2-4,10-11,13H,5-9,15H2,1H3/p+1/t13-/m0/s1