6-azanyl-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]purine-2-carbonitrile

Systemtic Name: 6-azanyl-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]purine-2-carbonitrile Openeye Name: 6-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purine-2-carbonitrile CAS Name: 6-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-purinecarbonitrile IUPAC Name: 6-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purine-2-carbonitrile Traditional Name: 6-amino-9-[(2R,4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]purine-2-carbonitrile Formula: C11H12N6O3 MolecularWeight: 276.25138

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=C(N=C3N)C#N)CO)O

Isomeric SMILES

C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2N=C(N=C3N)C#N)CO)O

InChI

InChI=1S/C11H12N6O3/c12-2-7-15-10(13)9-11(16-7)17(4-14-9)8-1-5(19)6(3-18)20-8/h4-6,8,18-19H,1,3H2,(H2,13,15,16)/t5-,6+,8+/m0/s1