[(2S)-2-cyclohexyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]azanium

Systemtic Name: [(2S)-2-cyclohexyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]azanium Openeye Name: [(2S)-2-cyclohexyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]ammonium CAS Name: [(2S)-2-cyclohexyl-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]ammonium IUPAC Name: [(2S)-2-cyclohexyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]azanium Traditional Name: [(2S)-2-cyclohexyl-2-[4-(2-pyrimidyl)piperazino]ethyl]ammonium Formula: C16H28N5+ MolecularWeight: 290.42702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C[NH3+])N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

C1CCC(CC1)[C@@H](C[NH3+])N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H27N5/c17-13-15(14-5-2-1-3-6-14)20-9-11-21(12-10-20)16-18-7-4-8-19-16/h4,7-8,14-15H,1-3,5-6,9-13,17H2/p+1/t15-/m1/s1