2-[4-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)carbonylpiperazin-1-ium-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)carbonylpiperazin-1-ium-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-(5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperazin-1-ium-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[(5,7-dimethyl-3-pyrazolo[1,5-a]pyrimidinyl)-oxomethyl]-1-piperazin-1-iumyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-(5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperazin-1-ium-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[4-(5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carbonyl)piperazin-1-ium-1-yl]-1-piperidino-ethanone Formula: C20H29N6O2+ MolecularWeight: 385.48326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C(C=NN12)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCCC4)C

Isomeric SMILES

CC1=CC(=NC2=C(C=NN12)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCCC4)C

InChI

InChI=1S/C20H28N6O2/c1-15-12-16(2)26-19(22-15)17(13-21-26)20(28)25-10-8-23(9-11-25)14-18(27)24-6-4-3-5-7-24/h12-13H,3-11,14H2,1-2H3/p+1