5-[2,6-bis(azanyl)purin-9-yl]-2-(hydroxymethyl)-3-oxidanyl-oxolane-2-carbonitrile

Systemtic Name: 5-[2,6-bis(azanyl)purin-9-yl]-2-(hydroxymethyl)-3-oxidanyl-oxolane-2-carbonitrile Openeye Name: 5-(2,6-diaminopurin-9-yl)-3-hydroxy-2-(hydroxymethyl)tetrahydrofuran-2-carbonitrile CAS Name: 5-(2,6-diamino-9-purinyl)-3-hydroxy-2-(hydroxymethyl)-2-oxolanecarbonitrile IUPAC Name: 5-(2,6-diaminopurin-9-yl)-3-hydroxy-2-(hydroxymethyl)oxolane-2-carbonitrile Traditional Name: 5-(2,6-diaminopurin-9-yl)-3-hydroxy-2-methylol-tetrahydrofuran-2-carbonitrile Formula: C11H13N7O3 MolecularWeight: 291.26602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N7O3/c12-2-11(3-19)5(20)1-6(21-11)18-4-15-7-8(13)16-10(14)17-9(7)18/h4-6,19-20H,1,3H2,(H4,13,14,16,17)