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4,7-dimethyl-6-[2-(4-phenethylpiperazin-4-ium-1-yl)ethyl]purino[7,8-a]imidazole-1,3-dione
4,7-dimethyl-6-[2-(4-phenethylpiperazin-4-ium-1-yl)ethyl]purino[7,8-a]imidazole-1,3-dione
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CN2C3=C(N=C2N1CCN4CC[NH+](CC4)CCC5=CC=CC=C5)N(C(=O)NC3=O)C
Isomeric SMILES
CC1=CN2C3=C(N=C2N1CCN4CC[NH+](CC4)CCC5=CC=CC=C5)N(C(=O)NC3=O)C
InChI
InChI=1S/C23H29N7O2/c1-17-16-30-19-20(26(2)23(32)25-21(19)31)24-22(30)29(17)15-14-28-12-10-27(11-13-28)9-8-18-6-4-3-5-7-18/h3-7,16H,8-15H2,1-2H3,(H,25,31,32)/p+1
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