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(2R)-2-[[9-ethyl-6-[(3-methoxyphenyl)amino]purin-2-yl]amino]butan-1-ol
(2R)-2-[[9-ethyl-6-[(3-methoxyphenyl)amino]purin-2-yl]amino]butan-1-ol
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Descriptors Computed from Structure
Canonical SMILES:
CCC(CO)NC1=NC2=C(C(=N1)NC3=CC(=CC=C3)OC)N=CN2CC
Isomeric SMILES
CC[C@H](CO)NC1=NC2=C(C(=N1)NC3=CC(=CC=C3)OC)N=CN2CC
InChI
InChI=1S/C18H24N6O2/c1-4-12(10-25)21-18-22-16(15-17(23-18)24(5-2)11-19-15)20-13-7-6-8-14(9-13)26-3/h6-9,11-12,25H,4-5,10H2,1-3H3,(H2,20,21,22,23)/t12-/m1/s1
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- methyl (2S)-4-methanoyloxy-1-(phenylmethoxycarbamoyl)piperidine-2-carboxylate
