3-chloranyl-2-methyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propyl]pyrazolo[1,5-a]quinazolin-5-amine

Systemtic Name: 3-chloranyl-2-methyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propyl]pyrazolo[1,5-a]quinazolin-5-amine Openeye Name: 3-chloro-2-methyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propyl]pyrazolo[1,5-a]quinazolin-5-amine CAS Name: 3-chloro-2-methyl-N-[3-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]propyl]-5-pyrazolo[1,5-a]quinazolinamine IUPAC Name: 3-chloro-2-methyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propyl]pyrazolo[1,5-a]quinazolin-5-amine Traditional Name: (3-chloro-2-methyl-pyrazolo[1,5-a]quinazolin-5-yl)-[3-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]propyl]amine Formula: C22H26ClN8+ MolecularWeight: 437.94844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C3=CC=CC=C3C(=NC2=C1Cl)NCCC[NH+]4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CC1=NN2C3=CC=CC=C3C(=NC2=C1Cl)NCCC[NH+]4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C22H25ClN8/c1-16-19(23)21-27-20(17-6-2-3-7-18(17)31(21)28-16)24-10-5-11-29-12-14-30(15-13-29)22-25-8-4-9-26-22/h2-4,6-9H,5,10-15H2,1H3,(H,24,27)/p+1