2-[2-chloranyl-6-(1-oxidanylpropan-2-ylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[2-chloranyl-6-(1-oxidanylpropan-2-ylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[2-chloro-6-[(2-hydroxy-1-methyl-ethyl)amino]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[2-chloro-6-(1-hydroxypropan-2-ylamino)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[2-chloro-6-(1-hydroxypropan-2-ylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[2-chloro-6-[(2-hydroxy-1-methyl-ethyl)amino]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C13H18ClN5O5 MolecularWeight: 359.76552

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)NC1=NC(=NC2=C1N=CN2C3C(C(C(O3)CO)O)O)Cl

Isomeric SMILES

CC(CO)NC1=NC(=NC2=C1N=CN2C3C(C(C(O3)CO)O)O)Cl

InChI

InChI=1S/C13H18ClN5O5/c1-5(2-20)16-10-7-11(18-13(14)17-10)19(4-15-7)12-9(23)8(22)6(3-21)24-12/h4-6,8-9,12,20-23H,2-3H2,1H3,(H,16,17,18)