5-tert-butyl-7-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 5-tert-butyl-7-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 7-(4-benzhydrylpiperazin-4-ium-1-yl)-5-tert-butyl-2-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidine CAS Name: 5-tert-butyl-7-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidine IUPAC Name: 7-(4-benzhydrylpiperazin-4-ium-1-yl)-5-tert-butyl-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidine Traditional Name: 7-(4-benzhydrylpiperazin-4-ium-1-yl)-5-tert-butyl-2-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidine Formula: C34H38N5+ MolecularWeight: 516.69902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C(=CC(=NC2=C1C3=CC=CC=C3)C(C)(C)C)N4CC[NH+](CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=NN2C(=CC(=NC2=C1C3=CC=CC=C3)C(C)(C)C)N4CC[NH+](CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H37N5/c1-25-31(26-14-8-5-9-15-26)33-35-29(34(2,3)4)24-30(39(33)36-25)37-20-22-38(23-21-37)32(27-16-10-6-11-17-27)28-18-12-7-13-19-28/h5-19,24,32H,20-23H2,1-4H3/p+1