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

Systemtic Name: 7-(4-cyclohexylpiperazin-4-ium-1-yl)-3-(2-methoxyphenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 7-(4-cyclohexylpiperazin-4-ium-1-yl)-3-(2-methoxyphenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidine CAS Name: 7-(4-cyclohexyl-1-piperazin-4-iumyl)-3-(2-methoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidine IUPAC Name: 7-(4-cyclohexylpiperazin-4-ium-1-yl)-3-(2-methoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidine Traditional Name: 7-(4-cyclohexylpiperazin-4-ium-1-yl)-3-(2-methoxyphenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidine Formula: C25H34N5O+ MolecularWeight: 420.57036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C(=C1)N3CC[NH+](CC3)C4CCCCC4)C)C5=CC=CC=C5OC

Isomeric SMILES

CC1=NC2=C(C(=NN2C(=C1)N3CC[NH+](CC3)C4CCCCC4)C)C5=CC=CC=C5OC

InChI

InChI=1S/C25H33N5O/c1-18-17-23(29-15-13-28(14-16-29)20-9-5-4-6-10-20)30-25(26-18)24(19(2)27-30)21-11-7-8-12-22(21)31-3/h7-8,11-12,17,20H,4-6,9-10,13-16H2,1-3H3/p+1