2-[4-[5-tert-butyl-3-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-[5-tert-butyl-3-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-[5-tert-butyl-3-(p-tolyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-[5-tert-butyl-3-(4-methylphenyl)-7-pyrazolo[1,5-a]pyrimidinyl]-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-[5-tert-butyl-3-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-[5-tert-butyl-3-(p-tolyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-ium-1-yl]ethanol Formula: C23H32N5O+ MolecularWeight: 394.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3N=C(C=C(N3N=C2)N4CC[NH+](CC4)CCO)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3N=C(C=C(N3N=C2)N4CC[NH+](CC4)CCO)C(C)(C)C

InChI

InChI=1S/C23H31N5O/c1-17-5-7-18(8-6-17)19-16-24-28-21(15-20(23(2,3)4)25-22(19)28)27-11-9-26(10-12-27)13-14-29/h5-8,15-16,29H,9-14H2,1-4H3/p+1