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

Systemtic Name: 5-tert-butyl-3-(4-methylphenyl)-7-[4-(6-methylpyridin-2-yl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine Openeye Name: 5-tert-butyl-7-[4-(6-methyl-2-pyridyl)piperazin-1-yl]-3-(p-tolyl)pyrazolo[1,5-a]pyrimidine CAS Name: 5-tert-butyl-3-(4-methylphenyl)-7-[4-(6-methyl-2-pyridinyl)-1-piperazinyl]pyrazolo[1,5-a]pyrimidine IUPAC Name: 5-tert-butyl-3-(4-methylphenyl)-7-[4-(6-methylpyridin-2-yl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine Traditional Name: 5-tert-butyl-7-[4-(6-methyl-2-pyridyl)piperazino]-3-(p-tolyl)pyrazolo[1,5-a]pyrimidine Formula: C27H32N6 MolecularWeight: 440.58318

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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(=N5)C)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3N=C(C=C(N3N=C2)N4CCN(CC4)C5=CC=CC(=N5)C)C(C)(C)C

InChI

InChI=1S/C27H32N6/c1-19-9-11-21(12-10-19)22-18-28-33-25(17-23(27(3,4)5)30-26(22)33)32-15-13-31(14-16-32)24-8-6-7-20(2)29-24/h6-12,17-18H,13-16H2,1-5H3