5-methyl-3-(4-methylphenyl)-7-[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine

Systemtic Name: 5-methyl-3-(4-methylphenyl)-7-[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine Openeye Name: 5-methyl-7-[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]-3-(p-tolyl)pyrazolo[1,5-a]pyrimidine CAS Name: 5-methyl-3-(4-methylphenyl)-7-[4-(6-methyl-2-pyridin-1-iumyl)-1-piperazinyl]pyrazolo[1,5-a]pyrimidine IUPAC Name: 5-methyl-3-(4-methylphenyl)-7-[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine Traditional Name: 5-methyl-7-[4-(6-methylpyridin-1-ium-2-yl)piperazino]-3-(p-tolyl)pyrazolo[1,5-a]pyrimidine Formula: C24H27N6+ MolecularWeight: 399.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3N=C(C=C(N3N=C2)N4CCN(CC4)C5=CC=CC(=[NH+]5)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3N=C(C=C(N3N=C2)N4CCN(CC4)C5=CC=CC(=[NH+]5)C)C

InChI

InChI=1S/C24H26N6/c1-17-7-9-20(10-8-17)21-16-25-30-23(15-19(3)27-24(21)30)29-13-11-28(12-14-29)22-6-4-5-18(2)26-22/h4-10,15-16H,11-14H2,1-3H3/p+1