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7-but-2-ynyl-1-methyl-8-piperazin-1-yl-3-propan-2-yl-purine-2,6-dione
7-but-2-ynyl-1-methyl-8-piperazin-1-yl-3-propan-2-yl-purine-2,6-dione
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Descriptors Computed from Structure
Canonical SMILES:
CC#CCN1C2=C(N=C1N3CCNCC3)N(C(=O)N(C2=O)C)C(C)C
Isomeric SMILES
CC#CCN1C2=C(N=C1N3CCNCC3)N(C(=O)N(C2=O)C)C(C)C
InChI
InChI=1S/C17H24N6O2/c1-5-6-9-22-13-14(19-16(22)21-10-7-18-8-11-21)23(12(2)3)17(25)20(4)15(13)24/h12,18H,7-11H2,1-4H3
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