[(2R,3S)-3-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)pentan-2-yl]azanium

Systemtic Name: [(2R,3S)-3-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)pentan-2-yl]azanium Openeye Name: [(1R,2S)-2-methyl-1-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]butyl]ammonium CAS Name: [(2R,3S)-3-methyl-1-[4-(2-pyrimidinyl)-1-piperazinyl]pentan-2-yl]ammonium IUPAC Name: [(2R,3S)-3-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)pentan-2-yl]azanium Traditional Name: [(1R,2S)-2-methyl-1-[[4-(2-pyrimidyl)piperazino]methyl]butyl]ammonium Formula: C14H26N5+ MolecularWeight: 264.38974

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CN1CCN(CC1)C2=NC=CC=N2)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@H](CN1CCN(CC1)C2=NC=CC=N2)[NH3+]

InChI

InChI=1S/C14H25N5/c1-3-12(2)13(15)11-18-7-9-19(10-8-18)14-16-5-4-6-17-14/h4-6,12-13H,3,7-11,15H2,1-2H3/p+1/t12-,13-/m0/s1