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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC([N+]1(C)C2=NC=NC=C2)C3=CC=C(C=C3)Cl)C4=CC=NN4

Isomeric SMILES

CC1CN(CC([N+]1(C)C2=NC=NC=C2)C3=CC=C(C=C3)Cl)C4=CC=NN4

InChI

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