7-(4-cyclopentylpiperazin-4-ium-1-yl)-5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 7-(4-cyclopentylpiperazin-4-ium-1-yl)-5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 7-(4-cyclopentylpiperazin-4-ium-1-yl)-5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidine CAS Name: 7-(4-cyclopentyl-1-piperazin-4-iumyl)-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidine IUPAC Name: 7-(4-cyclopentylpiperazin-4-ium-1-yl)-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidine Traditional Name: 7-(4-cyclopentylpiperazin-4-ium-1-yl)-5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidine Formula: C22H28N5+ MolecularWeight: 362.49122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C(=C1)N3CC[NH+](CC3)C4CCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=C(C=NN2C(=C1)N3CC[NH+](CC3)C4CCCC4)C5=CC=CC=C5

InChI

InChI=1S/C22H27N5/c1-17-15-21(26-13-11-25(12-14-26)19-9-5-6-10-19)27-22(24-17)20(16-23-27)18-7-3-2-4-8-18/h2-4,7-8,15-16,19H,5-6,9-14H2,1H3/p+1