4-[4-(4-chlorophenyl)-1,6-dimethyl-1-(1H-pyrazol-5-yl)piperazin-1-ium-2-yl]pyrimidine

Systemtic Name: 4-[4-(4-chlorophenyl)-1,6-dimethyl-1-(1H-pyrazol-5-yl)piperazin-1-ium-2-yl]pyrimidine Openeye Name: 4-[4-(4-chlorophenyl)-1,6-dimethyl-1-(1H-pyrazol-5-yl)piperazin-1-ium-2-yl]pyrimidine CAS Name: 4-[4-(4-chlorophenyl)-1,6-dimethyl-1-(1H-pyrazol-5-yl)-2-piperazin-1-iumyl]pyrimidine IUPAC Name: 4-[4-(4-chlorophenyl)-1,6-dimethyl-1-(1H-pyrazol-5-yl)piperazin-1-ium-2-yl]pyrimidine Traditional Name: 4-[4-(4-chlorophenyl)-1,6-dimethyl-1-(1H-pyrazol-5-yl)piperazin-1-ium-2-yl]pyrimidine Formula: C19H22ClN6+ MolecularWeight: 369.87118

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC([N+]1(C)C2=CC=NN2)C3=NC=NC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1CN(CC([N+]1(C)C2=CC=NN2)C3=NC=NC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H22ClN6/c1-14-11-25(16-5-3-15(20)4-6-16)12-18(17-7-9-21-13-22-17)26(14,2)19-8-10-23-24-19/h3-10,13-14,18H,11-12H2,1-2H3,(H,23,24)/q+1