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

Systemtic Name: 7-(4-cyclopentylpiperazin-4-ium-1-yl)-2,5-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 7-(4-cyclopentylpiperazin-4-ium-1-yl)-2,5-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidine CAS Name: 7-(4-cyclopentyl-1-piperazin-4-iumyl)-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidine IUPAC Name: 7-(4-cyclopentylpiperazin-4-ium-1-yl)-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidine Traditional Name: 7-(4-cyclopentylpiperazin-4-ium-1-yl)-2,5-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidine Formula: C23H30N5+ MolecularWeight: 376.5178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N5/c1-17-16-21(27-14-12-26(13-15-27)20-10-6-7-11-20)28-23(24-17)22(18(2)25-28)19-8-4-3-5-9-19/h3-5,8-9,16,20H,6-7,10-15H2,1-2H3/p+1