2-ethyl-9-(2-fluoranylethyl)-6-piperazin-1-yl-purine dihydrochloride

Systemtic Name: 2-ethyl-9-(2-fluoranylethyl)-6-piperazin-1-yl-purine dihydrochloride Openeye Name: 2-ethyl-9-(2-fluoroethyl)-6-piperazin-1-yl-purine dihydrochloride CAS Name: 2-ethyl-9-(2-fluoroethyl)-6-(1-piperazinyl)purine dihydrochloride IUPAC Name: 2-ethyl-9-(2-fluoroethyl)-6-piperazin-1-ylpurine dihydrochloride Traditional Name: 2-ethyl-9-(2-fluoroethyl)-6-piperazino-purine dihydrochloride Formula: C13H21Cl2FN6 MolecularWeight: 351.250443

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=N1)N3CCNCC3)N=CN2CCF.Cl.Cl

Isomeric SMILES

CCC1=NC2=C(C(=N1)N3CCNCC3)N=CN2CCF.Cl.Cl

InChI

InChI=1S/C13H19FN6.2ClH/c1-2-10-17-12(19-7-4-15-5-8-19)11-13(18-10)20(6-3-14)9-16-11;;/h9,15H,2-8H2,1H3;2*1H