1-[3-[[9-[5-(hydroxymethyl)-3-oxidanyl-oxolan-2-yl]purin-6-yl]amino]pyrrolidin-1-yl]ethanone

Systemtic Name: 1-[3-[[9-[5-(hydroxymethyl)-3-oxidanyl-oxolan-2-yl]purin-6-yl]amino]pyrrolidin-1-yl]ethanone Openeye Name: 1-[3-[[9-[3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-6-yl]amino]pyrrolidin-1-yl]ethanone CAS Name: 1-[3-[[9-[3-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-purinyl]amino]-1-pyrrolidinyl]ethanone IUPAC Name: 1-[3-[[9-[3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]pyrrolidin-1-yl]ethanone Traditional Name: 1-[3-[[9-(3-hydroxy-5-methylol-tetrahydrofuran-2-yl)purin-6-yl]amino]pyrrolidino]ethanone Formula: C16H22N6O4 MolecularWeight: 362.38368

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(C1)NC2=NC=NC3=C2N=CN3C4C(CC(O4)CO)O

Isomeric SMILES

CC(=O)N1CCC(C1)NC2=NC=NC3=C2N=CN3C4C(CC(O4)CO)O

InChI

InChI=1S/C16H22N6O4/c1-9(24)21-3-2-10(5-21)20-14-13-15(18-7-17-14)22(8-19-13)16-12(25)4-11(6-23)26-16/h7-8,10-12,16,23,25H,2-6H2,1H3,(H,17,18,20)