7-(4-cyclohexylpiperazin-4-ium-1-yl)-2-(3,4-dimethoxyphenyl)-5-methyl-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 7-(4-cyclohexylpiperazin-4-ium-1-yl)-2-(3,4-dimethoxyphenyl)-5-methyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 7-(4-cyclohexylpiperazin-4-ium-1-yl)-2-(3,4-dimethoxyphenyl)-5-methyl-pyrazolo[1,5-a]pyrimidine CAS Name: 7-(4-cyclohexyl-1-piperazin-4-iumyl)-2-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidine IUPAC Name: 7-(4-cyclohexylpiperazin-4-ium-1-yl)-2-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidine Traditional Name: 7-(4-cyclohexylpiperazin-4-ium-1-yl)-2-(3,4-dimethoxyphenyl)-5-methyl-pyrazolo[1,5-a]pyrimidine Formula: C25H34N5O2+ MolecularWeight: 436.56976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=NN2C(=C1)N3CC[NH+](CC3)C4CCCCC4)C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

CC1=NC2=CC(=NN2C(=C1)N3CC[NH+](CC3)C4CCCCC4)C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C25H33N5O2/c1-18-15-25(29-13-11-28(12-14-29)20-7-5-4-6-8-20)30-24(26-18)17-21(27-30)19-9-10-22(31-2)23(16-19)32-3/h9-10,15-17,20H,4-8,11-14H2,1-3H3/p+1