2-[4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-4-ium-1-yl]pyrimidine

Systemtic Name: 2-[4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-4-ium-1-yl]pyrimidine Openeye Name: 2-[4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-4-ium-1-yl]pyrimidine CAS Name: 2-[4-[[4-(1-pyrazolyl)phenyl]methyl]-1-piperazin-4-iumyl]pyrimidine IUPAC Name: 2-[4-[(4-pyrazol-1-ylphenyl)methyl]piperazin-4-ium-1-yl]pyrimidine Traditional Name: 2-[4-(4-pyrazol-1-ylbenzyl)piperazin-4-ium-1-yl]pyrimidine Formula: C18H21N6+ MolecularWeight: 321.39954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)N3C=CC=N3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)N3C=CC=N3)C4=NC=CC=N4

InChI

InChI=1S/C18H20N6/c1-7-19-18(20-8-1)23-13-11-22(12-14-23)15-16-3-5-17(6-4-16)24-10-2-9-21-24/h1-10H,11-15H2/p+1